Binding 10μM Binding 1μM Functional 10μM ADME/T 10μM
| Name (Code) | Description | Organism Class | Size | Browse | Download (Annotations) |
|---|---|---|---|---|---|
| Z50607-1-O | Human immunodeficiency virus 1 (cluster #1 of 10) | Other | 1970 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-1-O | Rattus norvegicus (cluster #1 of 12) | Other | 1643 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARA-1-E | Peroxisome proliferator-activated receptor alpha (cluster #1 of 2) | Eukaryotes | 1545 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV1-1-E | Vanilloid receptor (cluster #1 of 4) | Eukaryotes | 1273 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARG-2-E | Peroxisome proliferator-activated receptor gamma (cluster #2 of 2) | Eukaryotes | 1213 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-4-O | Homo sapiens (cluster #4 of 9) | Other | 1205 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADRB3-1-E | Beta-3 adrenergic receptor (cluster #1 of 1) | Eukaryotes | 1175 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-1-O | Homo sapiens (cluster #1 of 9) | Other | 1125 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MCHR1-1-E | Melanin-concentrating hormone receptor 1 (cluster #1 of 1) | Eukaryotes | 1062 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-1-O | MCF7 (Breast carcinoma cells) (cluster #1 of 14) | Other | 1057 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-3-O | HCT-116 (Colon carcinoma cells) (cluster #3 of 9) | Other | 1039 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PRGR-1-E | Progesterone receptor (cluster #1 of 2) | Eukaryotes | 1034 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-2-O | L1210 (Lymphocytic leukemia cells) (cluster #2 of 12) | Other | 973 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-3-O | Plasmodium falciparum (cluster #3 of 22) | Other | 959 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-1-O | Cavia porcellus (cluster #1 of 7) | Other | 891 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GCR-1-E | Glucocorticoid receptor (cluster #1 of 2) | Eukaryotes | 849 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITB3-1-E | Integrin beta-3 (cluster #1 of 2) | Eukaryotes | 821 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MC4R-1-E | Melanocortin receptor 4 (cluster #1 of 1) | Eukaryotes | 796 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PTAFR-1-E | Platelet activating factor receptor (cluster #1 of 3) | Eukaryotes | 781 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT6R-1-E | 5-hydroxytryptamine receptor 6 (cluster #1 of 1) | Eukaryotes | 769 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A3-1-E | Dopamine transporter (cluster #1 of 1) | Eukaryotes | 764 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARD-1-E | Peroxisome proliferator-activated receptor delta (cluster #1 of 2) | Eukaryotes | 761 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITA2B-1-E | Integrin alpha-IIb (cluster #1 of 2) | Eukaryotes | 727 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ANDR-1-E | Androgen Receptor (cluster #1 of 3) | Eukaryotes | 711 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100081-1-O | PBMC (Peripheral blood mononuclear cells) (cluster #1 of 4) | Other | 711 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80548-1-O | THP-1 (Acute monocytic leukemia cells) (cluster #1 of 5) | Other | 685 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-1-O | HeLa (Cervical adenocarcinoma cells) (cluster #1 of 9) | Other | 659 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ESR2-1-E | Estrogen receptor beta (cluster #1 of 2) | Eukaryotes | 655 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A4-1-E | Serotonin transporter (cluster #1 of 1) | Eukaryotes | 653 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ESR1-1-E | Estrogen receptor alpha (cluster #1 of 3) | Eukaryotes | 636 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA2AR-1-E | Adenosine A2a receptor (cluster #1 of 1) | Eukaryotes | 626 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GHSR-1-E | Ghrelin receptor (cluster #1 of 1) | Eukaryotes | 623 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CNR2-1-E | Cannabinoid CB2 receptor (cluster #1 of 2) | Eukaryotes | 600 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RX7-1-E | P2X purinoceptor 7 (cluster #1 of 1) | Eukaryotes | 582 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARG-1-E | Peroxisome proliferator-activated receptor gamma (cluster #1 of 2) | Eukaryotes | 576 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80874-1-O | CEM (T-cell leukemia) (cluster #1 of 7) | Other | 568 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRM-1-E | Mu opioid receptor (cluster #1 of 2) | Eukaryotes | 566 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADRB1-1-E | Beta-1 adrenergic receptor (cluster #1 of 1) | Eukaryotes | 540 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-1-O | A549 (Lung carcinoma cells) (cluster #1 of 11) | Other | 539 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1C-1-E | Voltage-gated L-type calcium channel alpha-1C subunit (cluster #1 of 1) | Eukaryotes | 535 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ANDR-2-E | Androgen Receptor (cluster #2 of 3) | Eukaryotes | 525 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-1-O | Mus musculus (cluster #1 of 9) | Other | 506 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FNTA-1-E | Protein farnesyltransferase/geranylgeranyltransferase type I alpha subunit (cluster #1 of 2) | Eukaryotes | 503 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADRB2-1-E | Beta-2 adrenergic receptor (cluster #1 of 2) | Eukaryotes | 493 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA2BR-1-E | Adenosine A2b receptor (cluster #1 of 1) | Eukaryotes | 491 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FNTB-1-E | Protein farnesyltransferase beta subunit (cluster #1 of 2) | Eukaryotes | 490 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CCR2-1-E | C-C chemokine receptor type 2 (cluster #1 of 1) | Eukaryotes | 484 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRK-1-E | Kappa opioid receptor (cluster #1 of 1) | Eukaryotes | 483 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRD-1-E | Delta opioid receptor (cluster #1 of 1) | Eukaryotes | 482 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-1-O | A2780 (Ovarian carcinoma cells) (cluster #1 of 10) | Other | 478 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GNRHR-1-E | Gonadotropin-releasing hormone receptor (cluster #1 of 1) | Eukaryotes | 477 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EGFR-1-E | Epidermal growth factor receptor erbB1 (cluster #1 of 2) | Eukaryotes | 470 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD2-1-E | Dopamine D2 receptor (cluster #1 of 1) | Eukaryotes | 457 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81057-1-O | HUVEC (Umbilical vein endothelial cells) (cluster #1 of 4) | Other | 454 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1D-1-E | Voltage-gated L-type calcium channel alpha-1D subunit (cluster #1 of 1) | Eukaryotes | 452 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-3-O | Oryctolagus cuniculus (cluster #3 of 8) | Other | 440 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV1-2-E | Vanilloid receptor (cluster #2 of 4) | Eukaryotes | 417 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VGFR2-1-E | Vascular endothelial growth factor receptor 2 (cluster #1 of 2) | Eukaryotes | 411 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80951-1-O | NIH3T3 (Fibroblasts) (cluster #1 of 4) | Other | 409 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-1-O | P388 (Lymphoma cells) (cluster #1 of 8) | Other | 392 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PTAFR-3-E | Platelet activating factor receptor (cluster #3 of 3) | Eukaryotes | 385 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGTR1-1-E | Angiotensin II type 1a (AT-1a) receptor (cluster #1 of 1) | Eukaryotes | 384 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-1-O | HT-29 (Colon adenocarcinoma cells) (cluster #1 of 12) | Other | 373 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-1-O | PC-3 (Prostate carcinoma cells) (cluster #1 of 10) | Other | 373 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-1-O | HCT-116 (Colon carcinoma cells) (cluster #1 of 9) | Other | 368 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9WTR4-1-E | Norepinephrine transporter (cluster #1 of 2) | Eukaryotes | 362 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BKRB1-1-E | Bradykinin B1 receptor (cluster #1 of 1) | Eukaryotes | 358 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA1R-1-E | Adenosine A1 receptor (cluster #1 of 1) | Eukaryotes | 356 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81170-1-O | LNCaP (Prostate carcinoma) (cluster #1 of 5) | Other | 355 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH3-2-E | Histamine H3 receptor (cluster #2 of 2) | Eukaryotes | 347 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CXCR3-1-E | C-X-C chemokine receptor type 3 (cluster #1 of 1) | Eukaryotes | 344 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2B-1-E | Serotonin 2b (5-HT2b) receptor (cluster #1 of 2) | Eukaryotes | 339 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TA2R-1-E | Thromboxane A2 receptor (cluster #1 of 1) | Eukaryotes | 334 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM5-2-E | Metabotropic glutamate receptor 5 (cluster #2 of 5) | Eukaryotes | 333 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NR1H2-1-E | LXR-beta (cluster #1 of 2) | Eukaryotes | 330 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-1-O | K562 (Erythroleukemia cells) (cluster #1 of 11) | Other | 326 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GPR44-1-E | G protein-coupled receptor 44 (cluster #1 of 2) | Eukaryotes | 323 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81331-1-O | SW-620 (Colon adenocarcinoma cells) (cluster #1 of 6) | Other | 318 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CALRL-1-E | Calcitonin gene-related peptide type 1 receptor (cluster #1 of 1) | Eukaryotes | 314 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MK14-1-E | MAP kinase p38 alpha (cluster #1 of 1) | Eukaryotes | 314 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA17-1-E | ADAM17 (cluster #1 of 1) | Eukaryotes | 312 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CLTR1-1-E | Cysteinyl leukotriene receptor 1 (cluster #1 of 1) | Eukaryotes | 312 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX5-1-E | Arachidonate 5-lipoxygenase (cluster #1 of 7) | Eukaryotes | 312 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX5-6-E | Arachidonate 5-lipoxygenase (cluster #6 of 7) | Eukaryotes | 310 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2C-1-E | 5-hydroxytryptamine receptor 2C (cluster #1 of 2) | Eukaryotes | 309 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50643-2-O | Hepatitis C virus (cluster #2 of 5) | Other | 299 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD4-1-E | Dopamine D4 receptor (cluster #1 of 1) | Eukaryotes | 298 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-1-O | Jurkat (Acute leukemic T-cells) (cluster #1 of 10) | Other | 289 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH1-1-E | Histamine H1 receptor (cluster #1 of 2) | Eukaryotes | 285 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CCR5-1-E | C-C chemokine receptor type 5 (cluster #1 of 1) | Eukaryotes | 282 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM1-2-E | Muscarinic acetylcholine receptor M1 (cluster #2 of 3) | Eukaryotes | 280 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-1-O | CCRF-CEM (T-cell leukemia) (cluster #1 of 9) | Other | 280 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD3-1-E | Dopamine D3 receptor (cluster #1 of 1) | Eukaryotes | 279 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80852-3-O | A-431 (Epidermoid carcinoma cells) (cluster #3 of 3) | Other | 271 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2Y12-1-E | Purinergic receptor P2Y12 (cluster #1 of 2) | Eukaryotes | 268 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BRS3-1-E | Bombesin receptor subtype-3 (cluster #1 of 1) | Eukaryotes | 267 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PTAFR-2-E | Platelet activating factor receptor (cluster #2 of 3) | Eukaryotes | 265 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA3R-1-E | Adenosine A3 receptor (cluster #1 of 1) | Eukaryotes | 262 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R3-1-E | Prostanoid EP3 receptor (cluster #1 of 2) | Eukaryotes | 260 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-3-O | A2780 (Ovarian carcinoma cells) (cluster #3 of 10) | Other | 260 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1A-1-E | Serotonin 1a (5-HT1a) receptor (cluster #1 of 2) | Eukaryotes | 255 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MK11-1-E | MAP kinase p38 beta (cluster #1 of 1) | Eukaryotes | 247 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MK12-1-E | MAP kinase p38 gamma (cluster #1 of 1) | Eukaryotes | 247 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MK13-1-E | MAP kinase p38 delta (cluster #1 of 1) | Eukaryotes | 247 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RY1-1-E | P2Y purinoceptor 1 (cluster #1 of 1) | Eukaryotes | 247 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2A-1-E | Serotonin 2a (5-HT2a) receptor (cluster #1 of 2) | Eukaryotes | 241 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-5-O | Homo sapiens (cluster #5 of 9) | Other | 239 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CASR-1-E | Calcium sensing receptor (cluster #1 of 1) | Eukaryotes | 238 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MCR-1-E | Mineralocorticoid receptor (cluster #1 of 2) | Eukaryotes | 238 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-3-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #3 of 11) | Other | 238 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD1-1-E | Dopamine D1 receptor (cluster #1 of 1) | Eukaryotes | 237 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GASR-1-E | Cholecystokinin B receptor (cluster #1 of 1) | Eukaryotes | 233 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PD2R-1-E | Prostanoid DP receptor (cluster #1 of 1) | Eukaryotes | 233 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80164-1-O | HT-1080 (Fibrosarcoma cells) (cluster #1 of 6) | Other | 233 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81011-1-O | human cell lines (cluster #1 of 3) | Other | 232 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80936-1-O | HEK293 (Embryonic kidney fibroblasts) (cluster #1 of 4) | Other | 231 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RXRA-1-E | Retinoid X receptor alpha (cluster #1 of 1) | Eukaryotes | 228 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SL9A1-1-E | Sodium/hydrogen exchanger 1 (cluster #1 of 1) | Eukaryotes | 228 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM1-1-E | Metabotropic glutamate receptor 1 (cluster #1 of 5) | Eukaryotes | 225 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SRC-1-E | Tyrosine-protein kinase SRC (cluster #1 of 1) | Eukaryotes | 225 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2C-2-E | 5-hydroxytryptamine receptor 2C (cluster #2 of 2) | Eukaryotes | 224 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MSHR-1-E | Melanocortin receptor 1 (cluster #1 of 1) | Eukaryotes | 222 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80269-1-O | MKN-45 (Gastric adenocarcinoma cells) (cluster #1 of 3) | Other | 221 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CLTR2-1-E | Cysteinyl leukotriene receptor 2 (cluster #1 of 1) | Eukaryotes | 218 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q72547-1-V | Human immunodeficiency virus type 1 reverse transcriptase (cluster #1 of 1) | Viruses | 218 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM5-3-E | Metabotropic glutamate receptor 5 (cluster #3 of 5) | Eukaryotes | 214 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-1-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #1 of 8) | Other | 213 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LT4R1-1-E | Leukotriene B4 receptor 1 (cluster #1 of 1) | Eukaryotes | 212 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OXYR-1-E | Oxytocin receptor (cluster #1 of 2) | Eukaryotes | 211 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R4-1-E | Prostanoid EP4 receptor (cluster #1 of 1) | Eukaryotes | 210 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NR1H4-1-E | Bile acid receptor FXR (cluster #1 of 2) | Eukaryotes | 208 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q72874-1-V | Human immunodeficiency virus type 1 protease (cluster #1 of 1) | Viruses | 208 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NR1H3-1-E | LXR-alpha (cluster #1 of 1) | Eukaryotes | 206 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CNR1-1-E | Cannabinoid CB1 receptor (cluster #1 of 2) | Eukaryotes | 205 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-2-O | HL-60 (Promyeloblast leukemia cells) (cluster #2 of 12) | Other | 205 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80475-3-O | SK-BR-3 (Breast adenocarcinoma) (cluster #3 of 3) | Other | 205 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2A-2-E | Serotonin 2a (5-HT2a) receptor (cluster #2 of 2) | Eukaryotes | 204 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CNR1-2-E | Cannabinoid CB1 receptor (cluster #2 of 2) | Eukaryotes | 203 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDFA-1-B | Multidrug translocase mdfA (cluster #1 of 1) | Bacteria | 203 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50677-1-O | Human immunodeficiency virus (cluster #1 of 3) | Other | 202 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CRFR1-1-E | Corticotropin releasing factor receptor 1 (cluster #1 of 1) | Eukaryotes | 201 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX5-2-E | Arachidonate 5-lipoxygenase (cluster #2 of 7) | Eukaryotes | 199 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB1-1-E | Tubulin beta-1 chain (cluster #1 of 2) | Eukaryotes | 195 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FFAR1-1-E | Free fatty acid receptor 1 (cluster #1 of 2) | Eukaryotes | 193 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| THAS-1-E | Thromboxane-A synthase (cluster #1 of 1) | Eukaryotes | 192 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EDNRA-1-E | Endothelin receptor ET-A (cluster #1 of 1) | Eukaryotes | 191 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-1-O | Oryctolagus cuniculus (cluster #1 of 8) | Other | 191 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CCR1-1-E | C-C chemokine receptor type 1 (cluster #1 of 1) | Eukaryotes | 190 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RY2-1-E | Purinergic receptor P2Y2 (cluster #1 of 1) | Eukaryotes | 190 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80566-1-O | U-937 (Histiocytic lymphoma cells) (cluster #1 of 2) | Other | 190 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80211-1-O | LoVo (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 189 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VGFR1-1-E | Vascular endothelial growth factor receptor 1 (cluster #1 of 2) | Eukaryotes | 186 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE2-1-E | Glutamate [NMDA] receptor subunit epsilon 2 (cluster #1 of 2) | Eukaryotes | 185 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81338-1-O | T-cells (cluster #1 of 3) | Other | 185 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MC3R-1-E | Melanocortin receptor 3 (cluster #1 of 1) | Eukaryotes | 183 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM3-2-E | Muscarinic acetylcholine receptor M3 (cluster #2 of 3) | Eukaryotes | 180 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| C5AR-1-E | C5a anaphylatoxin chemotactic receptor (cluster #1 of 1) | Eukaryotes | 178 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-2-O | MT4 (Lymphocytes) (cluster #2 of 8) | Other | 178 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80493-1-O | SK-OV-3 (Ovarian carcinoma cells) (cluster #1 of 6) | Other | 178 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TPOR-1-E | Thrombopoietin receptor (cluster #1 of 1) | Eukaryotes | 177 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104292-1-O | Integrin alpha-V/beta-3 (cluster #1 of 1) | Other | 176 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NPY5R-1-E | Neuropeptide Y receptor type 5 (cluster #1 of 1) | Eukaryotes | 175 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GP119-1-E | Glucose-dependent insulinotropic receptor (cluster #1 of 1) | Eukaryotes | 174 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM1-2-E | Metabotropic glutamate receptor 1 (cluster #2 of 5) | Eukaryotes | 172 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1B-1-E | Voltage-gated N-type calcium channel alpha-1B subunit (cluster #1 of 1) | Eukaryotes | 171 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103203-1-O | A375 (cluster #1 of 3) | Other | 170 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80175-1-O | IMR-32 (Neuroblastoma cells) (cluster #1 of 2) | Other | 170 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRX-1-E | Nociceptin receptor (cluster #1 of 1) | Eukaryotes | 167 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104293-1-O | Integrin alpha-4/beta-1 (cluster #1 of 1) | Other | 167 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM2-1-E | Muscarinic acetylcholine receptor M2 (cluster #1 of 3) | Eukaryotes | 166 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1S-1-E | Voltage-gated L-type calcium channel alpha-1S subunit (cluster #1 of 1) | Eukaryotes | 166 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM2-2-E | Metabotropic glutamate receptor 2 (cluster #2 of 2) | Eukaryotes | 166 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RX3-1-E | P2X purinoceptor 3 (cluster #1 of 1) | Eukaryotes | 165 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104302-1-O | Glutamate NMDA receptor (cluster #1 of 3) | Other | 165 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VGFR3-1-E | Vascular endothelial growth factor receptor 3 (cluster #1 of 2) | Eukaryotes | 163 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERBB2-2-E | Receptor protein-tyrosine kinase erbB-2 (cluster #2 of 3) | Eukaryotes | 162 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH3-1-E | Histamine H3 receptor (cluster #1 of 2) | Eukaryotes | 162 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MC5R-1-E | Melanocortin receptor 5 (cluster #1 of 1) | Eukaryotes | 161 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80125-1-O | DU-145 (Prostate carcinoma) (cluster #1 of 9) | Other | 161 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB2B-1-E | Tubulin beta chain (cluster #1 of 2) | Eukaryotes | 160 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2B-2-E | Serotonin 2b (5-HT2b) receptor (cluster #2 of 2) | Eukaryotes | 159 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-6-O | P388 (Lymphoma cells) (cluster #6 of 8) | Other | 155 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EDNRB-1-E | Endothelin receptor ET-B (cluster #1 of 1) | Eukaryotes | 153 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| V1AR-1-E | Vasopressin V1a receptor (cluster #1 of 2) | Eukaryotes | 152 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-2-O | T47D (Breast carcinoma cells) (cluster #2 of 7) | Other | 151 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81115-2-O | KB (Squamous cell carcinoma) (cluster #2 of 6) | Other | 151 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104283-1-O | Neuronal acetylcholine receptor; alpha4/beta2 (cluster #1 of 2) | Other | 149 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NK1R-1-E | Neurokinin 1 receptor (cluster #1 of 1) | Eukaryotes | 148 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104288-1-O | Neuronal acetylcholine receptor; alpha3/beta4 (cluster #1 of 1) | Other | 148 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102213-1-O | Blood (cluster #1 of 2) | Other | 147 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LT4R2-1-E | Leukotriene B4 receptor 2 (cluster #1 of 1) | Eukaryotes | 146 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| APH1A-1-E | Gamma-secretase subunit APH-1A (cluster #1 of 1) | Eukaryotes | 145 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| APH1B-1-E | Gamma-secretase subunit APH-1B (cluster #1 of 1) | Eukaryotes | 145 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NICA-1-E | Nicastrin (cluster #1 of 1) | Eukaryotes | 145 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PEN2-1-E | Gamma-secretase subunit PEN-2 (cluster #1 of 1) | Eukaryotes | 145 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1A-1-E | Alpha-1a adrenergic receptor (cluster #1 of 2) | Eukaryotes | 144 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-11-O | Plasmodium falciparum (cluster #11 of 22) | Other | 144 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80954-1-O | HFF (Foreskin fibroblasts) (cluster #1 of 4) | Other | 144 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CCR3-1-E | C-C chemokine receptor type 3 (cluster #1 of 1) | Eukaryotes | 143 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV2-1-E | Transient receptor potential cation channel subfamily V member 2 (cluster #1 of 3) | Eukaryotes | 143 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-6-O | MT4 (Lymphocytes) (cluster #6 of 8) | Other | 142 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA4-1-E | Glutamate receptor ionotropic, AMPA 4 (cluster #1 of 3) | Eukaryotes | 141 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TOP1-1-E | DNA topoisomerase I (cluster #1 of 1) | Eukaryotes | 141 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV4-1-E | Transient receptor potential cation channel subfamily V member 4 (cluster #1 of 3) | Eukaryotes | 141 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80548-4-O | THP-1 (Acute monocytic leukemia cells) (cluster #4 of 5) | Other | 141 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA1-1-E | Glutamate receptor ionotropic, AMPA 1 (cluster #1 of 3) | Eukaryotes | 140 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SMO-1-E | Smoothened homolog (cluster #1 of 1) | Eukaryotes | 139 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50737-1-O | Human immunodeficiency virus 3 (cluster #1 of 1) | Other | 139 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGH2-1-E | Cyclooxygenase-2 (cluster #1 of 1) | Eukaryotes | 138 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM5-1-E | Metabotropic glutamate receptor 5 (cluster #1 of 5) | Eukaryotes | 137 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50418-2-O | Trypanosoma brucei (cluster #2 of 6) | Other | 137 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OX2R-1-E | Orexin receptor 2 (cluster #1 of 1) | Eukaryotes | 136 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| V2R-1-E | Vasopressin V2 receptor (cluster #1 of 1) | Eukaryotes | 136 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80036-1-O | BaF3 (IL-3-dependent pro-B-cells) (cluster #1 of 3) | Other | 134 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNA3-2-E | Voltage-gated potassium channel subunit Kv1.3 (cluster #2 of 2) | Eukaryotes | 133 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ANDR-3-E | Androgen Receptor (cluster #3 of 3) | Eukaryotes | 131 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RX2-1-E | P2X purinoceptor 2 (cluster #1 of 1) | Eukaryotes | 131 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81245-1-O | MDA-MB-435 (Breast carcinoma cells) (cluster #1 of 6) | Other | 131 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB2B-2-E | Tubulin beta chain (cluster #2 of 2) | Eukaryotes | 130 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-5-O | HL-60 (Promyeloblast leukemia cells) (cluster #5 of 12) | Other | 129 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-3-O | PC-3 (Prostate carcinoma cells) (cluster #3 of 10) | Other | 128 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MP2K1-2-E | Dual specificity mitogen-activated protein kinase kinase 1 (cluster #2 of 2) | Eukaryotes | 127 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50530-1-O | Human herpesvirus 5 (cluster #1 of 5) | Other | 127 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80120-1-O | DLD-1 (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 127 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGFRB-1-E | Platelet-derived growth factor receptor beta (cluster #1 of 1) | Eukaryotes | 126 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA7-1-E | Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #1 of 4) | Eukaryotes | 125 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-4-O | Cavia porcellus (cluster #4 of 7) | Other | 125 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-4-O | Mus musculus (cluster #4 of 9) | Other | 125 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNA3-1-E | Voltage-gated potassium channel subunit Kv1.3 (cluster #1 of 2) | Eukaryotes | 124 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80066-1-O | CCRF-CEM/VCR-1000 (cluster #1 of 1) | Other | 122 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT3A-1-E | Serotonin 3a (5-HT3a) receptor (cluster #1 of 1) | Eukaryotes | 121 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CCKAR-1-E | Cholecystokinin A receptor (cluster #1 of 1) | Eukaryotes | 121 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC1-1-E | Histone deacetylase 1 (cluster #1 of 2) | Eukaryotes | 121 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SL9A2-1-E | Sodium/hydrogen exchanger 2 (cluster #1 of 1) | Eukaryotes | 120 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SL9A3-1-E | Sodium/hydrogen exchanger 3 (cluster #1 of 1) | Eukaryotes | 118 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-4-O | HT-29 (Colon adenocarcinoma cells) (cluster #4 of 12) | Other | 118 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CXCR4-1-E | C-X-C chemokine receptor type 4 (cluster #1 of 1) | Eukaryotes | 117 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80076-1-O | CEM-SS (T-cell leukemia) (cluster #1 of 5) | Other | 117 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-2-O | HeLa (Cervical adenocarcinoma cells) (cluster #2 of 9) | Other | 117 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLR-1-E | Glucagon receptor (cluster #1 of 1) | Eukaryotes | 116 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGTR2-1-E | Angiotensin II type 2 (AT-2) receptor (cluster #1 of 1) | Eukaryotes | 115 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TAAR1-2-E | Trace amine-associated receptor 1 (cluster #2 of 2) | Eukaryotes | 115 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80901-1-O | HaCaT (Keratinocytes) (cluster #1 of 2) | Other | 115 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1D-1-E | Alpha-1d adrenergic receptor (cluster #1 of 4) | Eukaryotes | 114 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NR1H4-2-E | Bile acid receptor FXR (cluster #2 of 2) | Eukaryotes | 114 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80877-2-O | NCI-H1299 (Non-small cell lung carcinoma) (cluster #2 of 2) | Other | 114 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE4A-1-E | Phosphodiesterase 4A (cluster #1 of 1) | Eukaryotes | 113 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q862F3-1-E | Tubulin alpha chain (cluster #1 of 2) | Eukaryotes | 113 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ESR1-2-E | Estrogen receptor alpha (cluster #2 of 3) | Eukaryotes | 112 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE4B-1-E | Phosphodiesterase 4B (cluster #1 of 1) | Eukaryotes | 112 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VDR-1-E | Vitamin D receptor (cluster #1 of 1) | Eukaryotes | 112 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NK3R-1-E | Neurokinin 3 receptor (cluster #1 of 1) | Eukaryotes | 110 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80344-1-O | NT2 (Teratocarcinoma cells) (cluster #1 of 1) | Other | 110 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S1PR1-2-E | Sphingosine 1-phosphate receptor Edg-1 (cluster #2 of 3) | Eukaryotes | 109 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA3-1-E | Glutamate receptor ionotropic, AMPA 3 (cluster #1 of 2) | Eukaryotes | 108 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80285-2-O | MOLT-4 (Acute T-lymphoblastic leukemia cells) (cluster #2 of 4) | Other | 108 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TLR7-1-E | Toll-like receptor 7 (cluster #1 of 1) | Eukaryotes | 107 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100081-2-O | PBMC (Peripheral blood mononuclear cells) (cluster #2 of 4) | Other | 107 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81346-1-O | Melanophores (Melanophore cells) (cluster #1 of 1) | Other | 107 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RY6-1-E | Pyrimidinergic receptor P2Y6 (cluster #1 of 1) | Eukaryotes | 106 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80418-2-O | RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #2 of 9) | Other | 106 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A2-1-E | Norepinephrine transporter (cluster #1 of 3) | Eukaryotes | 105 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GCR-2-E | Glucocorticoid receptor (cluster #2 of 2) | Eukaryotes | 104 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PSN1-1-E | Presenilin-1 (cluster #1 of 2) | Eukaryotes | 104 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PSN2-1-E | Presenilin-2 (cluster #1 of 2) | Eukaryotes | 104 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80088-1-O | CHO (Ovarian cells) (cluster #1 of 4) | Other | 103 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NPSR1-1-E | Neuropeptide S receptor (cluster #1 of 1) | Eukaryotes | 102 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PRGR-2-E | Progesterone receptor (cluster #2 of 2) | Eukaryotes | 102 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-6-O | A2780 (Ovarian carcinoma cells) (cluster #6 of 10) | Other | 102 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ESR2-2-E | Estrogen receptor beta (cluster #2 of 2) | Eukaryotes | 101 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBA1A-1-E | Tubulin alpha-1 chain (cluster #1 of 2) | Eukaryotes | 101 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80052-1-O | C8166 (Leukemic T-cells) (cluster #1 of 3) | Other | 101 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2Y14-1-E | P2Y purinoceptor 14 (cluster #1 of 2) | Eukaryotes | 100 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| V1BR-1-E | Vasopressin V1b receptor (cluster #1 of 1) | Eukaryotes | 100 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80240-1-O | MDA-MB-361 (cluster #1 of 1) | Other | 100 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81115-1-O | KB (Squamous cell carcinoma) (cluster #1 of 6) | Other | 100 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81135-1-O | L6 (Skeletal muscle myoblast cells) (cluster #1 of 4) | Other | 100 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S1PR3-1-E | Sphingosine 1-phosphate receptor Edg-3 (cluster #1 of 1) | Eukaryotes | 99 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80294-1-O | MT2 (Lymphocytes) (cluster #1 of 1) | Other | 99 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT4R-1-E | Serotonin 4 (5-HT4) receptor (cluster #1 of 1) | Eukaryotes | 98 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1A-2-E | Alpha-1a adrenergic receptor (cluster #2 of 2) | Eukaryotes | 98 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KIF11-1-E | Kinesin-like protein 1 (cluster #1 of 1) | Eukaryotes | 97 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LKHA4-1-E | Leukotriene A4 hydrolase (cluster #1 of 1) | Eukaryotes | 97 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80110-1-O | CV-1 (Kidney cells) (cluster #1 of 2) | Other | 97 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50588-3-O | Canis familiaris (cluster #3 of 7) | Other | 96 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-3-O | Human immunodeficiency virus 1 (cluster #3 of 10) | Other | 96 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-5-O | HCT-116 (Colon carcinoma cells) (cluster #5 of 9) | Other | 96 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80169-1-O | Huh-7 (Hepatocellular carcinoma) (cluster #1 of 1) | Other | 95 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80526-1-O | SW480 (Colon adenocarcinoma cells) (cluster #1 of 6) | Other | 95 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-3-O | HepG2 (Hepatoblastoma cells) (cluster #3 of 8) | Other | 95 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA2-1-E | Glutamate receptor ionotropic, AMPA 2 (cluster #1 of 4) | Eukaryotes | 94 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM3-1-E | Metabotropic glutamate receptor 3 (cluster #1 of 2) | Eukaryotes | 93 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGH1-1-E | Cyclooxygenase-1 (cluster #1 of 2) | Eukaryotes | 93 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80768-1-O | CH1 (Ovarian carcinoma cells) (cluster #1 of 1) | Other | 93 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OX1R-1-E | Orexin receptor 1 (cluster #1 of 1) | Eukaryotes | 91 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80035-1-O | B16 (Melanoma cells) (cluster #1 of 7) | Other | 91 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-1-O | HL-60 (Promyeloblast leukemia cells) (cluster #1 of 12) | Other | 91 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80300-1-O | N87 (Gastric carcinoma cells) (cluster #1 of 1) | Other | 91 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80384-1-O | PBL (Peripheral blood lymphocytes) (cluster #1 of 1) | Other | 91 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80416-1-O | Rat1 (Fibroblast cells) (cluster #1 of 1) | Other | 91 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-7-O | Plasmodium falciparum (cluster #7 of 22) | Other | 89 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CFTR-1-E | Cystic fibrosis transmembrane conductance regulator (cluster #1 of 1) | Eukaryotes | 87 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITB2-1-E | Integrin beta-2 (cluster #1 of 1) | Eukaryotes | 87 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GPBAR-2-E | G-protein coupled bile acid receptor 1 (cluster #2 of 2) | Eukaryotes | 86 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNA5-1-E | Voltage-gated potassium channel subunit Kv1.5 (cluster #1 of 1) | Eukaryotes | 86 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE4D-1-E | Phosphodiesterase 4D (cluster #1 of 1) | Eukaryotes | 86 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| UR2R-1-E | Urotensin II receptor (cluster #1 of 1) | Eukaryotes | 86 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-2-O | HepG2 (Hepatoblastoma cells) (cluster #2 of 8) | Other | 86 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PAR1-2-E | Proteinase activated receptor 1 (cluster #2 of 2) | Eukaryotes | 85 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MK08-1-E | c-Jun N-terminal kinase 1 (cluster #1 of 1) | Eukaryotes | 84 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDZ1-3-E | Glutamate (NMDA) receptor subunit zeta 1 (cluster #3 of 3) | Eukaryotes | 84 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| V1AR-2-E | Vasopressin V1a receptor (cluster #2 of 2) | Eukaryotes | 84 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CCR8-1-E | C-C chemokine receptor type 8 (cluster #1 of 1) | Eukaryotes | 83 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IRK11-1-E | Potassium channel, inwardly rectifying, subfamily J, member 11 (cluster #1 of 1) | Eukaryotes | 83 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE4C-1-E | Phosphodiesterase 4C (cluster #1 of 1) | Eukaryotes | 83 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102306-1-O | Aorta (cluster #1 of 6) | Other | 83 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1A-2-E | Serotonin 1a (5-HT1a) receptor (cluster #2 of 2) | Eukaryotes | 82 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1D-1-E | Serotonin 1d (5-HT1d) receptor (cluster #1 of 2) | Eukaryotes | 82 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITAL-1-E | Leukocyte adhesion glycoprotein LFA-1 alpha (cluster #1 of 2) | Eukaryotes | 82 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80961-1-O | HN5 (Squamous cell carcinoma) (cluster #1 of 1) | Other | 82 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDZ1-2-E | Glutamate (NMDA) receptor subunit zeta 1 (cluster #2 of 3) | Eukaryotes | 81 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN2A-1-E | Sodium channel protein type II alpha subunit (cluster #1 of 3) | Eukaryotes | 81 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50472-1-O | Toxoplasma gondii (cluster #1 of 4) | Other | 81 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-6-O | HCT-116 (Colon carcinoma cells) (cluster #6 of 9) | Other | 81 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100405-1-O | MV4-11 (Myeloid leukemia cells) (cluster #1 of 1) | Other | 80 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD5-1-E | Dopamine D5 receptor (cluster #1 of 1) | Eukaryotes | 79 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RY4-1-E | Pyrimidinergic receptor P2Y4 (cluster #1 of 1) | Eukaryotes | 79 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100744-1-O | Monocytes (cluster #1 of 1) | Other | 79 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-2-O | Trypanosoma brucei brucei (cluster #2 of 7) | Other | 79 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ABCC8-1-E | Sulfonylurea receptor 1 (cluster #1 of 1) | Eukaryotes | 78 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM3-1-E | Muscarinic acetylcholine receptor M3 (cluster #1 of 3) | Eukaryotes | 78 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FPR2-2-E | Lipoxin A4 receptor (cluster #2 of 2) | Eukaryotes | 78 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FSHR-1-E | Follicle stimulating hormone receptor (cluster #1 of 1) | Eukaryotes | 78 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MK09-1-E | c-Jun N-terminal kinase 2 (cluster #1 of 1) | Eukaryotes | 78 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-1-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #1 of 9) | Other | 78 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50590-1-O | Sus scrofa (cluster #1 of 1) | Other | 78 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-7-O | HepG2 (Hepatoblastoma cells) (cluster #7 of 8) | Other | 77 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNN2-1-E | Small conductance calcium-activated potassium channel protein 2 (cluster #1 of 2) | Eukaryotes | 76 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-6-O | K562 (Erythroleukemia cells) (cluster #6 of 11) | Other | 76 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNN1-1-E | Small conductance calcium-activated potassium channel protein 1 (cluster #1 of 2) | Eukaryotes | 75 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNN3-1-E | Small conductance calcium-activated potassium channel protein 3 (cluster #1 of 2) | Eukaryotes | 75 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX5-5-E | Arachidonate 5-lipoxygenase (cluster #5 of 7) | Eukaryotes | 75 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50362-1-O | Lactobacillus casei (cluster #1 of 1) | Other | 75 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81133-1-O | L1210 (1565) (cluster #1 of 1) | Other | 75 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM1-3-E | Muscarinic acetylcholine receptor M1 (cluster #3 of 3) | Eukaryotes | 74 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGFRA-1-E | Platelet-derived growth factor receptor alpha (cluster #1 of 1) | Eukaryotes | 74 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q862L2-1-E | Tubulin alpha-1 chain (cluster #1 of 2) | Eukaryotes | 74 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80107-1-O | COS-7 (Kidney cells) (cluster #1 of 2) | Other | 74 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDR1-1-E | P-glycoprotein 1 (cluster #1 of 2) | Eukaryotes | 73 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOD1-1-E | Nucleotide-binding oligomerization domain-containing protein 1 (cluster #1 of 1) | Eukaryotes | 73 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PAR1-1-E | Proteinase activated receptor 1 (cluster #1 of 2) | Eukaryotes | 73 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80106-1-O | COS-1 (Kidney cells) (cluster #1 of 1) | Other | 73 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ATP4A-1-E | Potassium-transporting ATPase alpha chain 1 (cluster #1 of 2) | Eukaryotes | 72 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ATP4B-1-E | Potassium-transporting ATPase beta chain (cluster #1 of 2) | Eukaryotes | 72 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TGFR1-1-E | TGF-beta receptor type I (cluster #1 of 1) | Eukaryotes | 72 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1G-1-E | Voltage-gated T-type calcium channel alpha-1G subunit (cluster #1 of 1) | Eukaryotes | 71 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PA2GA-1-E | Phospholipase A2 group IIA (cluster #1 of 1) | Eukaryotes | 71 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FGFR1-1-E | Fibroblast growth factor receptor 1 (cluster #1 of 1) | Eukaryotes | 70 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNH2-1-E | HERG (cluster #1 of 2) | Eukaryotes | 70 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN8A-1-E | Sodium channel protein type VIII alpha subunit (cluster #1 of 1) | Eukaryotes | 70 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80565-1-O | U-87 MG (Glioblastoma cells) (cluster #1 of 2) | Other | 70 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ABCC9-1-E | Sulfonylurea receptor 2 (cluster #1 of 1) | Eukaryotes | 69 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IRK8-1-E | Potassium channel, inwardly rectifying, subfamily J, member 8 (cluster #1 of 1) | Eukaryotes | 69 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PA24A-1-E | Cytosolic phospholipase A2 (cluster #1 of 1) | Eukaryotes | 69 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9BEG3-1-E | Arachidonate 5-lipoxygenase (cluster #1 of 1) | Eukaryotes | 69 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-1-O | Trypanosoma cruzi (cluster #1 of 8) | Other | 69 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-10-O | Rattus norvegicus (cluster #10 of 12) | Other | 69 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG2-1-E | GABA receptor gamma-2 subunit (cluster #1 of 2) | Eukaryotes | 68 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NFKB1-1-E | Nuclear factor NF-kappa-B p105 subunit (cluster #1 of 1) | Eukaryotes | 68 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NFKB2-1-E | Nuclear factor NF-kappa-B p100/p49 subunits (cluster #1 of 1) | Eukaryotes | 68 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRTS-1-E | Dihydrofolate reductase (cluster #1 of 1) | Eukaryotes | 67 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LIPS-1-E | Hormone sensitive lipase (cluster #1 of 1) | Eukaryotes | 67 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RXRB-1-E | Retinoid X receptor beta (cluster #1 of 1) | Eukaryotes | 67 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN5A-1-E | Sodium channel protein type V alpha subunit (cluster #1 of 1) | Eukaryotes | 67 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104301-1-O | GABA-A receptor; anion channel (cluster #1 of 2) | Other | 67 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50588-2-O | Canis familiaris (cluster #2 of 7) | Other | 67 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-7-O | MT4 (Lymphocytes) (cluster #7 of 8) | Other | 67 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-4-O | HepG2 (Hepatoblastoma cells) (cluster #4 of 8) | Other | 67 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FOS-1-E | Proto-oncogene protein c-fos (cluster #1 of 1) | Eukaryotes | 66 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITA2B-2-E | Integrin alpha-IIb (cluster #2 of 2) | Eukaryotes | 66 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| JUN-1-E | Proto-oncogene c-JUN (cluster #1 of 1) | Eukaryotes | 66 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S12A5-1-E | Solute carrier family 12 member 5 (cluster #1 of 1) | Eukaryotes | 66 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB4B-1-E | Tubulin beta-2 chain (cluster #1 of 3) | Eukaryotes | 66 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80354-1-O | OVCAR-3 (Ovarian adenocarcinoma cells) (cluster #1 of 4) | Other | 66 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81068-1-O | Ishikawa (Uterine carcinoma cells) (cluster #1 of 1) | Other | 66 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BKRB2-1-E | Bradykinin B2 receptor (cluster #1 of 1) | Eukaryotes | 65 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGTB1-1-E | Geranylgeranyl transferase type I beta subunit (cluster #1 of 1) | Eukaryotes | 65 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q862F3-2-E | Tubulin alpha chain (cluster #2 of 2) | Eukaryotes | 65 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPA1-2-E | Transient receptor potential cation channel subfamily A member 1 (cluster #2 of 6) | Eukaryotes | 65 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACES-1-E | Acetylcholinesterase (cluster #1 of 1) | Eukaryotes | 64 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EGFR-2-E | Epidermal growth factor receptor erbB1 (cluster #2 of 2) | Eukaryotes | 64 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S1PR4-1-E | Sphingosine 1-phosphate receptor Edg-6 (cluster #1 of 1) | Eukaryotes | 64 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB3-1-E | Tubulin beta-3 chain (cluster #1 of 3) | Eukaryotes | 64 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB4A-1-E | Tubulin beta-4 chain (cluster #1 of 3) | Eukaryotes | 64 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB8-1-E | Tubulin beta-8 chain (cluster #1 of 3) | Eukaryotes | 64 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100750-1-O | Osteoclasts (cluster #1 of 1) | Other | 64 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50442-1-O | Candida albicans (cluster #1 of 4) | Other | 64 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-5-O | Cavia porcellus (cluster #5 of 7) | Other | 64 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE3A-1-E | Phosphodiesterase 3A (cluster #1 of 1) | Eukaryotes | 63 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE3B-1-E | Phosphodiesterase 3B (cluster #1 of 1) | Eukaryotes | 63 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HS90B-1-E | Heat shock protein HSP 90-beta (cluster #1 of 3) | Eukaryotes | 62 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R2-1-E | Prostanoid EP2 receptor (cluster #1 of 1) | Eukaryotes | 62 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q862L2-2-E | Tubulin alpha-1 chain (cluster #2 of 2) | Eukaryotes | 62 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TNR1A-1-E | Tumor necrosis factor receptor R1 (cluster #1 of 1) | Eukaryotes | 62 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103205-1-O | A431 (cluster #1 of 4) | Other | 62 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-3-O | Rattus norvegicus (cluster #3 of 12) | Other | 62 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50643-5-O | Hepatitis C virus (cluster #5 of 5) | Other | 62 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-2-O | A549 (Lung carcinoma cells) (cluster #2 of 11) | Other | 62 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CHK1-1-E | Serine/threonine-protein kinase Chk1 (cluster #1 of 1) | Eukaryotes | 61 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104297-1-O | Glutamate NMDA receptor; GRIN1/GRIN2B (cluster #1 of 1) | Other | 61 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80477-1-O | SK_HEP1 (Hepatoma cells) (cluster #1 of 1) | Other | 61 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK1-1-E | Glutamate receptor ionotropic kainate 1 (cluster #1 of 2) | Eukaryotes | 60 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NPY2R-1-E | Neuropeptide Y receptor type 2 (cluster #1 of 1) | Eukaryotes | 60 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE5A-1-E | Phosphodiesterase 5A (cluster #1 of 1) | Eukaryotes | 60 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-12-O | Rattus norvegicus (cluster #12 of 12) | Other | 60 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HCAR2-3-E | HM74 nicotinic acid GPCR (cluster #3 of 3) | Eukaryotes | 59 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITK-1-E | Tyrosine-protein kinase ITK/TSK (cluster #1 of 1) | Eukaryotes | 59 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A11-1-E | GABA transporter 3 (cluster #1 of 2) | Eukaryotes | 59 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A13-1-E | GABA transporter 2 (cluster #1 of 2) | Eukaryotes | 59 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM2-2-E | Muscarinic acetylcholine receptor M2 (cluster #2 of 3) | Eukaryotes | 58 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA3-2-E | Glutamate receptor ionotropic, AMPA 3 (cluster #2 of 2) | Eukaryotes | 58 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTR1B-1-E | Melatonin receptor 1B (cluster #1 of 1) | Eukaryotes | 58 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITAV-1-E | Vitronectin receptor alpha (cluster #1 of 1) | Eukaryotes | 57 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1B-1-E | Serotonin 1b (5-HT1b) receptor (cluster #1 of 2) | Eukaryotes | 56 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT3B-1-E | Serotonin 3b (5-HT3b) receptor (cluster #1 of 1) | Eukaryotes | 56 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GSK3B-1-E | Glycogen synthase kinase-3 beta (cluster #1 of 1) | Eukaryotes | 56 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104302-3-O | Glutamate NMDA receptor (cluster #3 of 3) | Other | 56 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50266-1-O | Enterococcus faecium (cluster #1 of 1) | Other | 56 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80453-1-O | SC-3 (cluster #1 of 2) | Other | 56 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CXCR2-3-E | C-X-C chemokine receptor type 2 (cluster #3 of 3) | Eukaryotes | 55 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HS90A-1-E | Heat shock protein HSP 90-alpha (cluster #1 of 3) | Eukaryotes | 55 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX5-3-E | Arachidonate 5-lipoxygenase (cluster #3 of 7) | Eukaryotes | 55 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RENI-1-E | Renin (cluster #1 of 1) | Eukaryotes | 55 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-5-O | MCF7 (Breast carcinoma cells) (cluster #5 of 14) | Other | 55 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM1-1-E | Muscarinic acetylcholine receptor M1 (cluster #1 of 3) | Eukaryotes | 54 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1F-1-E | Voltage-gated L-type calcium channel alpha-1F subunit (cluster #1 of 1) | Eukaryotes | 54 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA4-2-E | Glutamate receptor ionotropic, AMPA 4 (cluster #2 of 3) | Eukaryotes | 54 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A5-1-E | Glycine transporter 2 (cluster #1 of 1) | Eukaryotes | 54 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-2-O | K562 (Erythroleukemia cells) (cluster #2 of 11) | Other | 54 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM2-1-E | Metabotropic glutamate receptor 2 (cluster #1 of 2) | Eukaryotes | 53 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-1-O | Plasmodium falciparum (cluster #1 of 22) | Other | 53 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50424-1-O | Cryptosporidium parvum (cluster #1 of 2) | Other | 52 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80037-1-O | Balb/MK (cluster #1 of 1) | Other | 52 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80152-1-O | HCT-8 (Ileocecal adenocarcinoma) (cluster #1 of 2) | Other | 52 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ICAM1-1-E | Intercellular adhesion molecule-1 (cluster #1 of 2) | Eukaryotes | 51 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NFAC1-1-E | Nuclear factor of activated T-cells cytoplasmic 1 (cluster #1 of 1) | Eukaryotes | 51 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NFAC2-1-E | Nuclear factor of activated T-cells cytoplasmic 2 (cluster #1 of 1) | Eukaryotes | 51 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOS1-3-E | Nitric-oxide synthase, brain (cluster #3 of 3) | Eukaryotes | 51 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOS2-2-E | Nitric oxide synthase, inducible (cluster #2 of 3) | Eukaryotes | 51 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A9-1-E | Glycine transporter 1 (cluster #1 of 1) | Eukaryotes | 51 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80054-1-O | Caco-2 (Colon adenocarcinoma cells) (cluster #1 of 4) | Other | 51 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80493-2-O | SK-OV-3 (Ovarian carcinoma cells) (cluster #2 of 6) | Other | 51 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADK-1-E | Adenosine kinase (cluster #1 of 1) | Eukaryotes | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FGFR2-1-E | Fibroblast growth factor receptor 2 (cluster #1 of 1) | Eukaryotes | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FGFR3-1-E | Fibroblast growth factor receptor 3 (cluster #1 of 1) | Eukaryotes | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA2-4-E | Glutamate receptor ionotropic, AMPA 2 (cluster #4 of 4) | Eukaryotes | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITA4-1-E | Integrin alpha-4 (cluster #1 of 1) | Eukaryotes | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITB1-1-E | Fibronectin receptor beta (cluster #1 of 1) | Eukaryotes | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MK10-1-E | c-Jun N-terminal kinase 3 (cluster #1 of 1) | Eukaryotes | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-6-O | Mus musculus (cluster #6 of 9) | Other | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80427-1-O | RKO (Colon carcinoma) (cluster #1 of 1) | Other | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-8-O | A549 (Lung carcinoma cells) (cluster #8 of 11) | Other | 50 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HCAR2-1-E | HM74 nicotinic acid GPCR (cluster #1 of 3) | Eukaryotes | 49 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTR1A-1-E | Melatonin receptor 1A (cluster #1 of 1) | Eukaryotes | 49 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RXRG-1-E | Retinoid X receptor gamma (cluster #1 of 2) | Eukaryotes | 49 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBA4A-1-E | Tubulin alpha-1 chain (cluster #1 of 1) | Eukaryotes | 49 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80018-2-O | A-375 (Malignant melanoma cells) (cluster #2 of 4) | Other | 49 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80092-2-O | CHO-K1 (Ovarian cells) (cluster #2 of 2) | Other | 49 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81335-1-O | HCT-15 (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 49 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FFAR2-1-E | Free fatty acid receptor 2 (cluster #1 of 1) | Eukaryotes | 48 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SGMR1-1-E | Sigma opioid receptor (cluster #1 of 1) | Eukaryotes | 48 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-4-O | Human immunodeficiency virus 1 (cluster #4 of 10) | Other | 48 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50725-1-O | Trypanosoma brucei rhodesiense (cluster #1 of 7) | Other | 48 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80475-1-O | SK-BR-3 (Breast adenocarcinoma) (cluster #1 of 3) | Other | 48 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80492-1-O | SK-N-SH (Neuroblastoma cells) (cluster #1 of 2) | Other | 48 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-2-O | A2780 (Ovarian carcinoma cells) (cluster #2 of 10) | Other | 48 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CCR4-1-E | C-C chemokine receptor type 4 (cluster #1 of 1) | Eukaryotes | 47 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FGFR4-1-E | Fibroblast growth factor receptor 4 (cluster #1 of 1) | Eukaryotes | 47 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITA3-1-E | Integrin alpha-3 (cluster #1 of 1) | Eukaryotes | 47 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NPY1R-1-E | Neuropeptide Y receptor type 1 (cluster #1 of 1) | Eukaryotes | 47 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN9A-1-E | Sodium channel protein type IX alpha subunit (cluster #1 of 1) | Eukaryotes | 47 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80862-1-O | GC3/MTK- cell line (cluster #1 of 1) | Other | 47 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80874-3-O | CEM (T-cell leukemia) (cluster #3 of 7) | Other | 47 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-7-O | HeLa (Cervical adenocarcinoma cells) (cluster #7 of 9) | Other | 46 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC4-1-E | Histone deacetylase 4 (cluster #1 of 2) | Eukaryotes | 45 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TIE2-1-E | Tyrosine-protein kinase TIE-2 (cluster #1 of 1) | Eukaryotes | 45 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80188-1-O | KB 3-1 (Cervical epithelial carcinoma cells) (cluster #1 of 2) | Other | 45 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80330-1-O | NCI-N87 (cluster #1 of 1) | Other | 45 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80334-1-O | NG108-15 (Neuroblastoma-glioma hybrid cells) (cluster #1 of 1) | Other | 45 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80792-1-O | Colon 26 (Colon adenocarcinoma cells) (cluster #1 of 2) | Other | 45 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-1-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #1 of 11) | Other | 45 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY1-2-E | Brain adenylate cyclase 1 (cluster #2 of 2) | Eukaryotes | 44 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ECR-1-E | Ecdysone receptor (cluster #1 of 1) | Eukaryotes | 44 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA2-2-E | Glutamate receptor ionotropic, AMPA 2 (cluster #2 of 4) | Eukaryotes | 44 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA4-3-E | Glutamate receptor ionotropic, AMPA 4 (cluster #3 of 3) | Eukaryotes | 44 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-3-O | Homo sapiens (cluster #3 of 9) | Other | 44 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50602-2-O | Human herpesvirus 1 (cluster #2 of 5) | Other | 44 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80548-3-O | THP-1 (Acute monocytic leukemia cells) (cluster #3 of 5) | Other | 44 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80874-2-O | CEM (T-cell leukemia) (cluster #2 of 7) | Other | 44 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-6-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #6 of 11) | Other | 44 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NR1I2-1-E | Pregnane X receptor (cluster #1 of 1) | Eukaryotes | 43 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q4U254-1-V | Human rhinovirus A protease (cluster #1 of 1) | Viruses | 43 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50185-2-O | Staphylococcus aureus (cluster #2 of 4) | Other | 43 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50658-1-O | Human immunodeficiency virus 2 (cluster #1 of 4) | Other | 43 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80175-2-O | IMR-32 (Neuroblastoma cells) (cluster #2 of 2) | Other | 43 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80897-1-O | H9 (T-lymphoid cells) (cluster #1 of 2) | Other | 43 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-5-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #5 of 8) | Other | 43 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA1-1-E | GABA receptor alpha-1 subunit (cluster #1 of 5) | Eukaryotes | 42 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MCHR2-1-E | Melanin-concentrating hormone receptor 2 (cluster #1 of 1) | Eukaryotes | 42 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOS3-2-E | Nitric-oxide synthase, endothelial (cluster #2 of 2) | Eukaryotes | 42 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-4-O | Trypanosoma cruzi (cluster #4 of 8) | Other | 42 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80099-1-O | COLO 205 (Colon adenocarcinoma cells) (cluster #1 of 3) | Other | 42 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-1-O | L1210 (Lymphocytic leukemia cells) (cluster #1 of 12) | Other | 42 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK5-1-E | Glutamate receptor ionotropic kainate 5 (cluster #1 of 1) | Eukaryotes | 41 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTLR-1-E | Motilin receptor (cluster #1 of 1) | Eukaryotes | 41 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PSN1-2-E | Presenilin-1 (cluster #2 of 2) | Eukaryotes | 41 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PSN2-2-E | Presenilin-2 (cluster #2 of 2) | Eukaryotes | 41 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80071-1-O | CEM-0 (T-cell leukemia) (cluster #1 of 2) | Other | 41 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80285-1-O | MOLT-4 (Acute T-lymphoblastic leukemia cells) (cluster #1 of 4) | Other | 41 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80742-1-O | C6 (Glioma cells) (cluster #1 of 3) | Other | 41 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHB2-1-E | Neuronal acetylcholine receptor protein beta-2 subunit (cluster #1 of 1) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHB4-1-E | Neuronal acetylcholine receptor protein beta-4 subunit (cluster #1 of 1) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAN1-1-E | Calpain 1 (cluster #1 of 1) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GIPR-1-E | Gastric inhibitory polypeptide receptor (cluster #1 of 1) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM4-1-E | Metabotropic glutamate receptor 4 (cluster #1 of 1) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM8-1-E | Metabotropic glutamate receptor 8 (cluster #1 of 2) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PAR4-1-E | Proteinase activated receptor 4 (cluster #1 of 1) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PI2R-1-E | Prostanoid IP receptor (cluster #1 of 1) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q8JXU8-1-V | Hepatitis C virus NS5B RNA-dependent RNA polymerase (cluster #1 of 1) | Viruses | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S1PR5-1-E | Sphingosine 1-phosphate receptor Edg-8 (cluster #1 of 1) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VGFR2-2-E | Vascular endothelial growth factor receptor 2 (cluster #2 of 2) | Eukaryotes | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50418-5-O | Trypanosoma brucei (cluster #5 of 6) | Other | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50591-2-O | Bos taurus (cluster #2 of 2) | Other | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-2-O | Human immunodeficiency virus 1 (cluster #2 of 10) | Other | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-8-O | Human immunodeficiency virus 1 (cluster #8 of 10) | Other | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80800-1-O | MIA PaCa-2 (Pancreatic carcinoma cells) (cluster #1 of 2) | Other | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80957-2-O | HMEC (Microvascular endothelial cells) (cluster #2 of 2) | Other | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81170-2-O | LNCaP (Prostate carcinoma) (cluster #2 of 5) | Other | 40 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EST1-1-E | Acyl coenzyme A:cholesterol acyltransferase (cluster #1 of 1) | Eukaryotes | 39 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK3-1-E | Glutamate receptor ionotropic kainate 3 (cluster #1 of 1) | Eukaryotes | 39 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HCAR2-2-E | HM74 nicotinic acid GPCR (cluster #2 of 3) | Eukaryotes | 39 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-2-O | Cavia porcellus (cluster #2 of 7) | Other | 39 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80005-1-O | 3T3 (Fibroblast cells) (cluster #1 of 2) | Other | 39 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FPR1-2-E | Formyl peptide receptor 1 (cluster #2 of 2) | Eukaryotes | 38 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80243-1-O | MDA-MB-453 (Breast adenocarcinoma cells) (cluster #1 of 1) | Other | 38 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80523-1-O | SW1353 (cluster #1 of 2) | Other | 38 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA3-3-E | Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #3 of 3) | Eukaryotes | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CXCR1-2-E | Interleukin-8 receptor A (cluster #2 of 2) | Eukaryotes | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA1-2-E | GABA receptor alpha-1 subunit (cluster #2 of 5) | Eukaryotes | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE4-2-E | Glutamate [NMDA] receptor subunit epsilon 4 (cluster #2 of 2) | Eukaryotes | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGH1-2-E | Cyclooxygenase-1 (cluster #2 of 2) | Eukaryotes | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RARB-1-E | Retinoic acid receptor beta (cluster #1 of 1) | Eukaryotes | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RARG-1-E | Retinoic acid receptor gamma (cluster #1 of 1) | Eukaryotes | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104290-1-O | Neuronal acetylcholine receptor; alpha4/beta2 (cluster #1 of 1) | Other | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50085-1-O | Human rhinovirus sp. (cluster #1 of 1) | Other | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-9-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #9 of 9) | Other | 37 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC2-1-E | Histone deacetylase 2 (cluster #1 of 2) | Eukaryotes | 36 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC3-1-E | Histone deacetylase 3 (cluster #1 of 2) | Eukaryotes | 36 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC8-1-E | Histone deacetylase 8 (cluster #1 of 2) | Eukaryotes | 36 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HMDH-1-E | HMG-CoA reductase (cluster #1 of 1) | Eukaryotes | 36 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RX1-1-E | P2X purinoceptor 1 (cluster #1 of 1) | Eukaryotes | 36 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A2-2-E | Norepinephrine transporter (cluster #2 of 3) | Eukaryotes | 36 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TAAR1-1-E | Trace amine-associated receptor 1 (cluster #1 of 2) | Eukaryotes | 36 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| THRB-1-E | Thrombin (cluster #1 of 1) | Eukaryotes | 36 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2B-2-E | Alpha-2b adrenergic receptor (cluster #2 of 3) | Eukaryotes | 35 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC5-1-E | Histone deacetylase 5 (cluster #1 of 2) | Eukaryotes | 35 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC7-1-E | Histone deacetylase 7 (cluster #1 of 2) | Eukaryotes | 35 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC9-1-E | Histone deacetylase 9 (cluster #1 of 2) | Eukaryotes | 35 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50185-3-O | Staphylococcus aureus (cluster #3 of 4) | Other | 35 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80262-1-O | NCI-H1975 (Bronchoalveolar carcinoma cells) (cluster #1 of 1) | Other | 35 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80485-1-O | SK-MEL-28 (Melanoma cells) (cluster #1 of 6) | Other | 35 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DHB1-1-E | Estradiol 17-beta-dehydrogenase 1 (cluster #1 of 1) | Eukaryotes | 34 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG2-2-E | GABA receptor gamma-2 subunit (cluster #2 of 2) | Eukaryotes | 34 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR3-1-E | Lysophosphatidic acid receptor Edg-7 (cluster #1 of 3) | Eukaryotes | 34 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VCAM1-1-E | Vascular cell adhesion protein 1 (cluster #1 of 1) | Eukaryotes | 34 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102352-1-O | Plasma (cluster #1 of 3) | Other | 34 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM4-1-E | Muscarinic acetylcholine receptor M4 (cluster #1 of 3) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FFAR1-2-E | Free fatty acid receptor 1 (cluster #2 of 2) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB2-2-E | GABA receptor beta-2 subunit (cluster #2 of 2) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLP1R-1-E | Glucagon-like peptide receptor (cluster #1 of 1) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK4-1-E | Glutamate receptor ionotropic kainate 4 (cluster #1 of 1) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE3-1-E | Glutamate [NMDA] receptor subunit epsilon 3 (cluster #1 of 2) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RARA-1-E | Retinoic acid receptor alpha (cluster #1 of 1) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A12-1-E | Betaine transporter (cluster #1 of 1) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A1-1-E | GABA transporter 1 (cluster #1 of 1) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB1-2-E | Tubulin beta-1 chain (cluster #2 of 2) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB3-2-E | Tubulin beta-3 chain (cluster #2 of 3) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB4A-2-E | Tubulin beta-4 chain (cluster #2 of 3) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB4B-2-E | Tubulin beta-2 chain (cluster #2 of 3) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB8-2-E | Tubulin beta-8 chain (cluster #2 of 3) | Eukaryotes | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-9-O | Plasmodium falciparum (cluster #9 of 22) | Other | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80563-1-O | U-373 MG ( Glioblastoma cells) (cluster #1 of 1) | Other | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80612-2-O | 2008 (Ovarian carcinoma cells) (cluster #2 of 2) | Other | 33 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM3-3-E | Muscarinic acetylcholine receptor M3 (cluster #3 of 3) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1B-1-E | Alpha-1b adrenergic receptor (cluster #1 of 1) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CRFR2-1-E | Corticotropin releasing factor receptor 2 (cluster #1 of 1) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB3-1-E | GABA receptor beta-3 subunit (cluster #1 of 2) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA1-2-E | Glutamate receptor ionotropic, AMPA 1 (cluster #2 of 3) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK2-1-E | Glutamate receptor ionotropic kainate 2 (cluster #1 of 2) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LUXR-1-B | Transcriptional activator protein luxR (cluster #1 of 2) | Bacteria | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDR1-2-E | P-glycoprotein 1 (cluster #2 of 2) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE2-2-E | Glutamate [NMDA] receptor subunit epsilon 2 (cluster #2 of 2) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RAMP1-1-E | Receptor activity-modifying protein 1 (cluster #1 of 1) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TAT-1-V | Human immunodeficiency virus type 1 Tat protein (cluster #1 of 2) | Viruses | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| THA-1-E | Thyroid hormone receptor alpha (cluster #1 of 1) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| THB-1-E | Thyroid hormone receptor beta-1 (cluster #1 of 1) | Eukaryotes | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-15-O | Plasmodium falciparum (cluster #15 of 22) | Other | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80046-1-O | BT-474 (Breast ductal carcinoma cells) (cluster #1 of 1) | Other | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80135-1-O | F9 (cluster #1 of 1) | Other | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-2-O | HCT-116 (Colon carcinoma cells) (cluster #2 of 9) | Other | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81065-1-O | IGROV-1 (Ovarian adenocarcinoma cells) (cluster #1 of 3) | Other | 32 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AMD-1-E | Peptidyl-glycine alpha-amidating monooxygenase (cluster #1 of 1) | Eukaryotes | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITA5-1-E | Fibronectin receptor alpha (cluster #1 of 1) | Eukaryotes | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX5-4-E | Arachidonate 5-lipoxygenase (cluster #4 of 7) | Eukaryotes | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPR-1-V | Human herpes virus 5 capsid protein P40 (cluster #1 of 1) | Viruses | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S1PR1-1-E | Sphingosine 1-phosphate receptor Edg-1 (cluster #1 of 3) | Eukaryotes | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SSR2-1-E | Somatostatin receptor 2 (cluster #1 of 1) | Eukaryotes | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB5-1-E | Tubulin beta-5 chain (cluster #1 of 1) | Eukaryotes | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRAR-1-B | Transcriptional activator protein traR (cluster #1 of 1) | Bacteria | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPA1-4-E | Transient receptor potential cation channel subfamily A member 1 (cluster #4 of 6) | Eukaryotes | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VE1-1-V | Replication protein E1 (cluster #1 of 1) | Viruses | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| WNT3-1-E | Proto-oncogene protein Wnt-3 (cluster #1 of 1) | Eukaryotes | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101839-1-O | HIV-1 M:B_Lai (cluster #1 of 1) | Other | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-5-O | Plasmodium falciparum (cluster #5 of 22) | Other | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80073-1-O | CEM-c113 (cluster #1 of 1) | Other | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80367-1-O | P388/S (cluster #1 of 1) | Other | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80493-3-O | SK-OV-3 (Ovarian carcinoma cells) (cluster #3 of 6) | Other | 31 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ESR1-3-E | Estrogen receptor alpha (cluster #3 of 3) | Eukaryotes | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HCAR3-2-E | HM74 nicotinic acid GPCR (cluster #2 of 2) | Eukaryotes | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITB6-1-E | Integrin beta-6 (cluster #1 of 1) | Eukaryotes | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNQ1-1-E | Voltage-gated potassium channel subunit Kv7.1 (cluster #1 of 1) | Eukaryotes | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR1-2-E | Lysophosphatidic acid receptor Edg-2 (cluster #2 of 4) | Eukaryotes | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LUXS-1-B | Transcriptional activator protein luxR (cluster #1 of 1) | Bacteria | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PF2R-1-E | Prostaglandin F2-alpha receptor (cluster #1 of 1) | Eukaryotes | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S1PR1-3-E | Sphingosine 1-phosphate receptor Edg-1 (cluster #3 of 3) | Eukaryotes | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80178-3-O | J774.A1 (Macrophage cells) (cluster #3 of 3) | Other | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80526-5-O | SW480 (Colon adenocarcinoma cells) (cluster #5 of 6) | Other | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-6-O | Jurkat (Acute leukemic T-cells) (cluster #6 of 10) | Other | 30 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT3C-1-E | Serotonin 3c (5-HT3c) receptor (cluster #1 of 1) | Eukaryotes | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT3D-1-E | Serotonin 3d (5-HT3d) receptor (cluster #1 of 1) | Eukaryotes | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT3E-1-E | Serotonin 3e (5-HT3e) receptor (cluster #1 of 1) | Eukaryotes | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY2-1-E | Adenylate cyclase type II (cluster #1 of 1) | Eukaryotes | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BACE1-1-E | Beta-secretase 1 (cluster #1 of 1) | Eukaryotes | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA2-1-E | GABA receptor alpha-2 subunit (cluster #1 of 4) | Eukaryotes | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA4-1-E | GABA receptor alpha-4 subunit (cluster #1 of 4) | Eukaryotes | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103203-2-O | A375 (cluster #2 of 3) | Other | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-8-O | Homo sapiens (cluster #8 of 9) | Other | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80026-1-O | AGS (Gastric adenocarcinoma cells) (cluster #1 of 2) | Other | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80208-1-O | L5178Y (Lymphoma cells) (cluster #1 of 2) | Other | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80296-1-O | MVLN (cluster #1 of 1) | Other | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80583-1-O | Vero (Kidney cells) (cluster #1 of 7) | Other | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80594-1-O | WIL2 (Lymphoblastoid cells) (cluster #1 of 1) | Other | 29 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1B-2-E | Serotonin 1b (5-HT1b) receptor (cluster #2 of 2) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHB-1-E | Acetylcholine receptor protein beta chain (cluster #1 of 1) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM5-2-E | Muscarinic acetylcholine receptor M5 (cluster #2 of 3) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2A-2-E | Alpha-2a adrenergic receptor (cluster #2 of 3) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BRAF-1-E | Serine/threonine-protein kinase B-raf (cluster #1 of 1) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CP26A-1-E | Cytochrome P450 26A1 (cluster #1 of 1) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA3-1-E | GABA receptor alpha-3 subunit (cluster #1 of 4) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCND3-1-E | Voltage-gated potassium channel subunit Kv4.3 (cluster #1 of 1) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KITH-1-V | Thymidine kinase (cluster #1 of 1) | Viruses | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MP2K2-2-E | Dual specificity mitogen-activated protein kinase kinase 2 (cluster #2 of 2) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9N6S8-1-E | Falcipain 2 (cluster #1 of 1) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9WTR4-2-E | Norepinephrine transporter (cluster #2 of 2) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A2-3-E | Norepinephrine transporter (cluster #3 of 3) | Eukaryotes | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100081-4-O | PBMC (Peripheral blood mononuclear cells) (cluster #4 of 4) | Other | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104282-1-O | Acetylcholine receptor; alpha1/beta1/delta/gamma (cluster #1 of 1) | Other | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-1-O | Leishmania donovani (cluster #1 of 8) | Other | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50527-1-O | Human herpesvirus 3 (cluster #1 of 3) | Other | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50609-1-O | Simian immunodeficiency virus (cluster #1 of 2) | Other | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50677-2-O | Human immunodeficiency virus (cluster #2 of 3) | Other | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80491-1-O | SK-N-MC (Neuroepithelioma cells) (cluster #1 of 4) | Other | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80495-1-O | SK-VLB (cluster #1 of 1) | Other | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81244-1-O | J774 (Macrophage cells) (cluster #1 of 1) | Other | 28 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHB3-1-E | Neuronal acetylcholine receptor protein beta-3 subunit (cluster #1 of 1) | Eukaryotes | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACOX1-1-E | Palmitoyl-CoA oxidase (cluster #1 of 1) | Eukaryotes | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IGF1R-1-E | Insulin-like growth factor I receptor (cluster #1 of 1) | Eukaryotes | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITB7-1-E | Integrin beta-7 (cluster #1 of 1) | Eukaryotes | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KIT-1-E | Stem cell growth factor receptor (cluster #1 of 1) | Eukaryotes | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SOAT1-1-E | Acyl coenzyme A:cholesterol acyltransferase 1 (cluster #1 of 1) | Eukaryotes | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SOAT2-1-E | Acyl coenzyme A:cholesterol acyltransferase 2 (cluster #1 of 1) | Eukaryotes | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100496-1-O | Huh-5-2 (Huh-7 with replicating HCV-RNA) (cluster #1 of 1) | Other | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102178-1-O | Liver microsomes (cluster #1 of 2) | Other | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-4-O | Plasmodium falciparum (cluster #4 of 22) | Other | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-6-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #6 of 9) | Other | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-2-O | Trypanosoma cruzi (cluster #2 of 8) | Other | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50608-1-O | Human immunodeficiency virus type 1 (RF/HAT ISOLATE) (cluster #1 of 1) | Other | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80107-2-O | COS-7 (Kidney cells) (cluster #2 of 2) | Other | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80691-1-O | BC cell line (cluster #1 of 1) | Other | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81057-2-O | HUVEC (Umbilical vein endothelial cells) (cluster #2 of 4) | Other | 27 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT7R-1-E | Serotonin 7 (5-HT7) receptor (cluster #1 of 1) | Eukaryotes | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2C-2-E | Alpha-2c adrenergic receptor (cluster #2 of 3) | Eukaryotes | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GHRHR-1-E | Growth hormone-releasing hormone receptor (cluster #1 of 1) | Eukaryotes | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM6-1-E | Metabotropic glutamate receptor 6 (cluster #1 of 2) | Eukaryotes | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HXK4-1-E | Hexokinase type IV (cluster #1 of 1) | Eukaryotes | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR1-1-E | Lysophosphatidic acid receptor Edg-2 (cluster #1 of 4) | Eukaryotes | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMBR-1-E | Neuromedin B receptor (cluster #1 of 1) | Eukaryotes | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TF65-1-E | Nuclear factor NF-kappa-B p65 subunit (cluster #1 of 1) | Eukaryotes | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPM8-1-E | Transient receptor potential cation channel subfamily M member 8 (cluster #1 of 1) | Eukaryotes | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100695-1-O | WRL68 (Embryonic hepatoma cells) (cluster #1 of 1) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-8-O | Oryctolagus cuniculus (cluster #8 of 8) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-6-O | Rattus norvegicus (cluster #6 of 12) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-7-O | Rattus norvegicus (cluster #7 of 12) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-2-O | MCF7 (Breast carcinoma cells) (cluster #2 of 14) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-1-O | MT4 (Lymphocytes) (cluster #1 of 8) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80418-3-O | RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #3 of 9) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80539-1-O | T98G (Glioblastoma cells) (cluster #1 of 1) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80561-1-O | U2OS (Osteosarcoma cells) (cluster #1 of 1) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80675-1-O | AG1523 (Fibroblast cells) (cluster #1 of 1) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80711-1-O | NCI/ADR-RES (Breast carcinoma cells) (cluster #1 of 2) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81017-1-O | WiDr (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81335-2-O | HCT-15 (Colon adenocarcinoma cells) (cluster #2 of 5) | Other | 26 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA3-2-E | Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #2 of 3) | Eukaryotes | 25 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MAPK2-1-E | MAP kinase-activated protein kinase 2 (cluster #1 of 1) | Eukaryotes | 25 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MRP1-1-E | Multidrug resistance-associated protein 1 (cluster #1 of 1) | Eukaryotes | 25 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q1A7N1-1-E | Transient receptor potential M8 protein (cluster #1 of 1) | Eukaryotes | 25 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104298-1-O | Glutamate NMDA receptor; GRIN1/GRIN2A (cluster #1 of 1) | Other | 25 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-2-O | Plasmodium falciparum (cluster #2 of 22) | Other | 25 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50679-2-O | Human rhinovirus 14 (cluster #2 of 2) | Other | 25 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-9-O | MCF7 (Breast carcinoma cells) (cluster #9 of 14) | Other | 25 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81184-1-O | LOX IMVI (Melanoma cells) (cluster #1 of 5) | Other | 25 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA7-3-E | Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #3 of 4) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM5-1-E | Muscarinic acetylcholine receptor M5 (cluster #1 of 3) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERR1-1-E | Estrogen-related receptor alpha (cluster #1 of 1) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDA10-1-E | Histone deacetylase 10 (cluster #1 of 1) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDA11-1-E | Histone deacetylase 11 (cluster #1 of 1) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC6-1-E | Histone deacetylase 6 (cluster #1 of 1) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH4-1-E | Histamine H4 receptor (cluster #1 of 2) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRP1-1-E | Histidine-rich protein (cluster #1 of 1) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITPR1-1-E | Inositol 1,4,5-trisphosphate receptor type 1 (cluster #1 of 1) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX5-7-E | Arachidonate 5-lipoxygenase (cluster #7 of 7) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE3-2-E | Glutamate [NMDA] receptor subunit epsilon 3 (cluster #2 of 2) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NTRK1-1-E | Nerve growth factor receptor Trk-A (cluster #1 of 1) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPA1-1-E | Transient receptor potential cation channel subfamily A member 1 (cluster #1 of 6) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VGFR1-2-E | Vascular endothelial growth factor receptor 1 (cluster #2 of 2) | Eukaryotes | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100275-1-O | Hemozoin (cluster #1 of 1) | Other | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50212-1-O | Escherichia coli (cluster #1 of 7) | Other | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50230-1-O | Yersinia pestis (cluster #1 of 1) | Other | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-6-O | Plasmodium falciparum (cluster #6 of 22) | Other | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-10-O | Human immunodeficiency virus 1 (cluster #10 of 10) | Other | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80063-1-O | CCRF S-180 (cluster #1 of 1) | Other | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80482-2-O | SK-MEL-2 (Melanoma cells) (cluster #2 of 4) | Other | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-1-O | HepG2 (Hepatoblastoma cells) (cluster #1 of 8) | Other | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-4-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #4 of 11) | Other | 24 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGTRB-1-E | Angiotensin II type 1b (AT-1b) receptor (cluster #1 of 1) | Eukaryotes | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DPP4-2-E | Dipeptidyl peptidase IV (cluster #2 of 2) | Eukaryotes | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERBB2-1-E | Receptor protein-tyrosine kinase erbB-2 (cluster #1 of 3) | Eukaryotes | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MADCA-1-E | Mucosal addressin cell adhesion molecule-1 (cluster #1 of 1) | Eukaryotes | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102222-1-O | Plasma (cluster #1 of 1) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80025-1-O | ACHN (Renal adenocarcinoma cells) (cluster #1 of 3) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-9-O | HL-60 (Promyeloblast leukemia cells) (cluster #9 of 12) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-12-O | HT-29 (Colon adenocarcinoma cells) (cluster #12 of 12) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-2-O | HT-29 (Colon adenocarcinoma cells) (cluster #2 of 12) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-2-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #2 of 7) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-4-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #4 of 7) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81057-4-O | HUVEC (Umbilical vein endothelial cells) (cluster #4 of 4) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81328-1-O | Src-transformed (Fibroblast cells) (cluster #1 of 1) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGTRA-1-E | Angiotensin II type 1a (AT-1a) receptor (cluster #1 of 1) | Eukaryotes | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AL5AP-1-E | 5-lipoxygenase activating protein (cluster #1 of 1) | Eukaryotes | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA1-3-E | GABA receptor alpha-1 subunit (cluster #3 of 5) | Eukaryotes | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TOP2A-1-E | DNA topoisomerase II alpha (cluster #1 of 1) | Eukaryotes | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TOP2B-1-E | DNA topoisomerase II beta (cluster #1 of 1) | Eukaryotes | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VGFR3-2-E | Vascular endothelial growth factor receptor 3 (cluster #2 of 2) | Eukaryotes | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50574-1-O | Xenopus sp. (cluster #1 of 2) | Other | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50626-1-O | Human papillomavirus (cluster #1 of 1) | Other | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80414-1-O | Raji (B-lymphoblastic cells) (cluster #1 of 3) | Other | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80419-1-O | RBL-1 (Basophilic leukemia cells) (cluster #1 of 2) | Other | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81335-4-O | HCT-15 (Colon adenocarcinoma cells) (cluster #4 of 5) | Other | 22 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| A4-1-E | Beta amyloid A4 protein (cluster #1 of 1) | Eukaryotes | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA3-1-E | Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #1 of 3) | Eukaryotes | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM4-3-E | Muscarinic acetylcholine receptor M4 (cluster #3 of 3) | Eukaryotes | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| C11B1-1-E | Cytochrome P450 11B1 (cluster #1 of 1) | Eukaryotes | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERG1-1-E | Squalene monooxygenase (cluster #1 of 2) | Eukaryotes | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GPBAR-1-E | G-protein coupled bile acid receptor 1 (cluster #1 of 2) | Eukaryotes | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITB3-2-E | Integrin beta-3 (cluster #2 of 2) | Eukaryotes | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MCR-2-E | Mineralocorticoid receptor (cluster #2 of 2) | Eukaryotes | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PKR1-1-E | Prokineticin receptor 1 (cluster #1 of 1) | Eukaryotes | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100766-2-O | Radical scavenging activity (cluster #2 of 2) | Other | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104287-2-O | Neuronal acetylcholine receptor; alpha3/beta4 (cluster #2 of 2) | Other | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-4-O | HL-60 (Promyeloblast leukemia cells) (cluster #4 of 12) | Other | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80185-1-O | JY (EBV-transformed B-lymphoblastoid cells) (cluster #1 of 1) | Other | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80291-1-O | MRC5 (Embryonic lung fibroblast cells) (cluster #1 of 3) | Other | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-2-O | PC-3 (Prostate carcinoma cells) (cluster #2 of 10) | Other | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80532-1-O | T-24 (Bladder carcinoma cells) (cluster #1 of 6) | Other | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81017-2-O | WiDr (Colon adenocarcinoma cells) (cluster #2 of 5) | Other | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81160-1-O | Lewis lung carcinoma cell line (cluster #1 of 1) | Other | 21 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM2-3-E | Muscarinic acetylcholine receptor M2 (cluster #3 of 3) | Eukaryotes | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2A-3-E | Alpha-2a adrenergic receptor (cluster #3 of 3) | Eukaryotes | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1H-1-E | Voltage-gated T-type calcium channel alpha-1H subunit (cluster #1 of 1) | Eukaryotes | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE1-1-E | Glutamate [NMDA] receptor subunit epsilon 1 (cluster #1 of 2) | Eukaryotes | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P97706-1-E | Sodium channel protein type VI alpha subunit (cluster #1 of 1) | Eukaryotes | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q7ZJM1-1-V | Human immunodeficiency virus type 1 integrase (cluster #1 of 1) | Viruses | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC5A2-1-E | Sodium/glucose cotransporter 2 (cluster #1 of 1) | Eukaryotes | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100751-1-O | PMNL (Polymorphonuclear leukocytes) (cluster #1 of 2) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50588-4-O | Canis familiaris (cluster #4 of 7) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-7-O | Mus musculus (cluster #7 of 9) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50600-1-O | Vaccinia virus (cluster #1 of 2) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80076-5-O | CEM-SS (T-cell leukemia) (cluster #5 of 5) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-4-O | K562 (Erythroleukemia cells) (cluster #4 of 11) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80418-9-O | RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #9 of 9) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80622-1-O | 3Y1 cell line (cluster #1 of 1) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80640-1-O | 786-0 (Renal carcinoma cells) (cluster #1 of 1) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-7-O | A549 (Lung carcinoma cells) (cluster #7 of 11) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80847-1-O | FaDu (Pharyngeal carcinoma cells) (cluster #1 of 3) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80890-1-O | H350.3 (MTX-resistant Reuber hepatoma cells) (cluster #1 of 1) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81280-1-O | NCI-H226 (Non-small cell lung carcinoma cells) (cluster #1 of 3) | Other | 20 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1E-1-E | Voltage-gated R-type calcium channel alpha-1E subunit (cluster #1 of 1) | Eukaryotes | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB1-1-E | GABA receptor beta-1 subunit (cluster #1 of 2) | Eukaryotes | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM7-1-E | Metabotropic glutamate receptor 7 (cluster #1 of 2) | Eukaryotes | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCB-1-E | Protein kinase C beta (cluster #1 of 1) | Eukaryotes | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDZ1-1-E | Glutamate (NMDA) receptor subunit zeta 1 (cluster #1 of 3) | Eukaryotes | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NR2E3-1-E | Photoreceptor-specific nuclear receptor (cluster #1 of 1) | Eukaryotes | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50725-3-O | Trypanosoma brucei rhodesiense (cluster #3 of 7) | Other | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80076-3-O | CEM-SS (T-cell leukemia) (cluster #3 of 5) | Other | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80171-1-O | HuTu80 (cluster #1 of 1) | Other | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80200-1-O | L1210 (RD1694) (cluster #1 of 1) | Other | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80600-1-O | XF498 (Glioma cells) (cluster #1 of 2) | Other | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-11-O | A549 (Lung carcinoma cells) (cluster #11 of 11) | Other | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80992-1-O | HSC-3 (Oral squamous cell carcinoma) (cluster #1 of 1) | Other | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81135-2-O | L6 (Skeletal muscle myoblast cells) (cluster #2 of 4) | Other | 19 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1F-1-E | Serotonin 1f (5-HT1f) receptor (cluster #1 of 1) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| A2AIR5-1-E | Glutamate [NMDA] receptor subunit 3A (cluster #1 of 1) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FPR1-1-E | Formyl peptide receptor 1 (cluster #1 of 2) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB2-1-E | GABA receptor beta-2 subunit (cluster #1 of 2) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITB5-1-E | Integrin beta-5 (cluster #1 of 1) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LSHR-1-E | Luteinizing hormone/Choriogonadotropin receptor (cluster #1 of 1) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MRGX1-1-E | Mas-related G-protein coupled receptor member X1 (cluster #1 of 1) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMD3B-2-E | Glutamate [NMDA] receptor subunit 3B (cluster #2 of 2) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE4-1-E | Glutamate [NMDA] receptor subunit epsilon 4 (cluster #1 of 2) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2Y14-2-E | P2Y purinoceptor 14 (cluster #2 of 2) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R1-1-E | Prostanoid EP1 receptor (cluster #1 of 2) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RIR1-1-V | Ribonucleoside-diphosphate reductase M1 chain (cluster #1 of 1) | Viruses | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RIR2-1-V | Ribonucleoside-diphosphate reductase M2 chain (cluster #1 of 1) | Viruses | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB3-3-E | Tubulin beta-3 chain (cluster #3 of 3) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB4A-3-E | Tubulin beta-4 chain (cluster #3 of 3) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB4B-3-E | Tubulin beta-2 chain (cluster #3 of 3) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB8-3-E | Tubulin beta-8 chain (cluster #3 of 3) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104283-2-O | Neuronal acetylcholine receptor; alpha4/beta2 (cluster #2 of 2) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50136-1-O | Plasmodium falciparum (isolate FcB1 / Columbia) (cluster #1 of 3) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-2-O | Oryctolagus cuniculus (cluster #2 of 8) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50606-1-O | Hepatitis B virus (cluster #1 of 3) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50658-3-O | Human immunodeficiency virus 2 (cluster #3 of 4) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80008-1-O | 5637 (Epithelial bladder carcinoma cells) (cluster #1 of 3) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-3-O | HL-60 (Promyeloblast leukemia cells) (cluster #3 of 12) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-6-O | MCF7 (Breast carcinoma cells) (cluster #6 of 14) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-10-O | PC-3 (Prostate carcinoma cells) (cluster #10 of 10) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80409-1-O | R2 (cluster #1 of 1) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80902-1-O | HASMC (Aortic smooth muscle cells) (cluster #1 of 2) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80951-4-O | NIH3T3 (Fibroblasts) (cluster #4 of 4) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-8-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #8 of 8) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81338-2-O | T-cells (cluster #2 of 3) | Other | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AMPC-1-B | Beta-lactamase (cluster #1 of 1) | Bacteria | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1A-1-E | Voltage-gated P/Q-type calcium channel alpha-1A subunit (cluster #1 of 1) | Eukaryotes | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERBB2-3-E | Receptor protein-tyrosine kinase erbB-2 (cluster #3 of 3) | Eukaryotes | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IKKB-1-E | Inhibitor of nuclear factor kappa B kinase beta subunit (cluster #1 of 1) | Eukaryotes | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR2-1-E | Lysophosphatidic acid receptor Edg-4 (cluster #1 of 4) | Eukaryotes | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR2-3-E | Lysophosphatidic acid receptor Edg-4 (cluster #3 of 4) | Eukaryotes | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TGFR2-1-E | TGF-beta receptor type II (cluster #1 of 1) | Eukaryotes | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV1-3-E | Vanilloid receptor (cluster #3 of 4) | Eukaryotes | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50591-1-O | Bos taurus (cluster #1 of 2) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50759-2-O | Dictyostelium discoideum (cluster #2 of 2) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80136-5-O | FM3A (Breast carcinoma cells) (cluster #5 of 6) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80227-1-O | MCF7-ADR (Breast carcinoma cells) (cluster #1 of 2) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80278-1-O | MMQ (cluster #1 of 1) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80372-1-O | P388CPT5 (cluster #1 of 1) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80525-1-O | SW48 (cluster #1 of 2) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80530-2-O | Swiss-3T3 (Fibroblast cells) (cluster #2 of 2) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80555-1-O | TSGH (cluster #1 of 1) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80957-1-O | HMEC (Microvascular endothelial cells) (cluster #1 of 2) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81001-1-O | TSGH 9201 (Gastric carcinoma cells) (cluster #1 of 1) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81054-1-O | SF-268 (Glioblastoma cells) (cluster #1 of 3) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81245-3-O | MDA-MB-435 (Breast carcinoma cells) (cluster #3 of 6) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-3-O | HeLa (Cervical adenocarcinoma cells) (cluster #3 of 9) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ALDR-1-E | Aldose reductase (cluster #1 of 1) | Eukaryotes | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| M3K8-1-E | Mitogen-activated protein kinase kinase kinase 8 (cluster #1 of 1) | Eukaryotes | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NK2R-1-E | Neurokinin 2 receptor (cluster #1 of 1) | Eukaryotes | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RASH-1-E | Transforming protein p21/H-Ras-1 (cluster #1 of 1) | Eukaryotes | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC5A1-1-E | Sodium/glucose cotransporter 1 (cluster #1 of 1) | Eukaryotes | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN1A-2-E | Sodium channel protein type I alpha subunit (cluster #2 of 2) | Eukaryotes | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN3A-2-E | Sodium channel protein type III alpha subunit (cluster #2 of 2) | Eukaryotes | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SSR3-1-E | Somatostatin receptor 3 (cluster #1 of 1) | Eukaryotes | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100490-1-O | ASPC1 (Pancreatic tumour cell line) (cluster #1 of 1) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100733-1-O | CT26 (Colon carcinoma cells) (cluster #1 of 1) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50186-2-O | Staphylococcus epidermidis (cluster #2 of 2) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50457-3-O | Leishmania amazonensis (cluster #3 of 3) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50472-3-O | Toxoplasma gondii (cluster #3 of 4) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50515-1-O | Human herpesvirus 2 (cluster #1 of 2) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50518-3-O | Human herpesvirus 4 (cluster #3 of 5) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-8-O | Rattus norvegicus (cluster #8 of 12) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50643-1-O | Hepatitis C virus (cluster #1 of 5) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50725-5-O | Trypanosoma brucei rhodesiense (cluster #5 of 7) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50725-7-O | Trypanosoma brucei rhodesiense (cluster #7 of 7) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-3-O | L1210 (Lymphocytic leukemia cells) (cluster #3 of 12) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80339-1-O | NRK (cluster #1 of 1) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80354-4-O | OVCAR-3 (Ovarian adenocarcinoma cells) (cluster #4 of 4) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80488-2-O | SK-MEL-5 (Melanoma cells) (cluster #2 of 3) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80583-7-O | Vero (Kidney cells) (cluster #7 of 7) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80897-2-O | H9 (T-lymphoid cells) (cluster #2 of 2) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80945-1-O | HEp-2 (Laryngeal carcinoma cells) (cluster #1 of 4) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81138-1-O | ScN2a (Scrapie-infected neuroblastoma cells) (cluster #1 of 3) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81199-1-O | NCI-H446 (Small cell lung carcinoma cells) (cluster #1 of 2) | Other | 16 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GAG-1-V | Gag polyprotein (cluster #1 of 1) | Viruses | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM1-4-E | Metabotropic glutamate receptor 1 (cluster #4 of 5) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ICAM1-2-E | Intercellular adhesion molecule-1 (cluster #2 of 2) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITAL-2-E | Leukocyte adhesion glycoprotein LFA-1 alpha (cluster #2 of 2) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LASR-1-B | Transcriptional activator protein lasR (cluster #1 of 1) | Bacteria | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NRAM-1-V | Neuraminidase (cluster #1 of 1) | Viruses | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| O77240-1-E | Ecdysone receptor (cluster #1 of 1) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OXYR-2-E | Oxytocin receptor (cluster #2 of 2) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PAFA-1-E | LDL-associated phospholipase A2 (cluster #1 of 1) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PAR2-1-E | Proteinase-activated receptor 2 (cluster #1 of 1) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PERT-1-E | Thyroid peroxidase (cluster #1 of 1) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN1A-1-E | Sodium channel protein type I alpha subunit (cluster #1 of 2) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN2A-3-E | Sodium channel protein type II alpha subunit (cluster #3 of 3) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN3A-1-E | Sodium channel protein type III alpha subunit (cluster #1 of 2) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100492-1-O | MCF10 (Normal breast epithelial cells) (cluster #1 of 1) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102015-1-O | Plasmodium vivax (cluster #1 of 1) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102178-2-O | Liver microsomes (cluster #2 of 2) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-1-O | Trypanosoma brucei brucei (cluster #1 of 7) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-6-O | Trypanosoma brucei brucei (cluster #6 of 7) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50468-2-O | Giardia intestinalis (cluster #2 of 4) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-6-O | Cavia porcellus (cluster #6 of 7) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-2-O | Rattus norvegicus (cluster #2 of 12) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-9-O | K562 (Erythroleukemia cells) (cluster #9 of 11) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80192-1-O | KM12 (Colon adenocarcinoma cells) (cluster #1 of 4) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-10-O | L1210 (Lymphocytic leukemia cells) (cluster #10 of 12) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-7-O | MCF7 (Breast carcinoma cells) (cluster #7 of 14) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80253-1-O | MEF (Embryonic fibroblast cells) (cluster #1 of 1) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80475-2-O | SK-BR-3 (Breast adenocarcinoma) (cluster #2 of 3) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80700-1-O | Beta-TC6 (Pancreatic insulinoma cells) (cluster #1 of 1) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80852-1-O | A-431 (Epidermoid carcinoma cells) (cluster #1 of 3) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81054-2-O | SF-268 (Glioblastoma cells) (cluster #2 of 3) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81115-4-O | KB (Squamous cell carcinoma) (cluster #4 of 6) | Other | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ABL1-1-E | Tyrosine-protein kinase ABL (cluster #1 of 2) | Eukaryotes | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA7-4-E | Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #4 of 4) | Eukaryotes | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM4-2-E | Muscarinic acetylcholine receptor M4 (cluster #2 of 3) | Eukaryotes | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM5-3-E | Muscarinic acetylcholine receptor M5 (cluster #3 of 3) | Eukaryotes | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY5-1-E | Adenylate cyclase type V (cluster #1 of 1) | Eukaryotes | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA2-3-E | Glutamate receptor ionotropic, AMPA 2 (cluster #3 of 4) | Eukaryotes | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNQ2-1-E | Voltage-gated potassium channel subunit Kv7.2 (cluster #1 of 1) | Eukaryotes | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LCK-2-E | Tyrosine-protein kinase LCK (cluster #2 of 2) | Eukaryotes | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LUXR-2-B | Transcriptional activator protein luxR (cluster #2 of 2) | Bacteria | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50038-1-O | Plasmodium yoelii yoelii (cluster #1 of 2) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50136-2-O | Plasmodium falciparum (isolate FcB1 / Columbia) (cluster #2 of 3) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-14-O | Plasmodium falciparum (cluster #14 of 22) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-4-O | Leishmania donovani (cluster #4 of 8) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-2-O | Homo sapiens (cluster #2 of 9) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50588-1-O | Canis familiaris (cluster #1 of 7) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-11-O | Rattus norvegicus (cluster #11 of 12) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80133-1-O | EMT6 (Mammary carcinoma cells) (cluster #1 of 3) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80136-1-O | FM3A (Breast carcinoma cells) (cluster #1 of 6) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80221-1-O | Manca (cluster #1 of 1) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80407-1-O | R1 (cluster #1 of 1) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80874-7-O | CEM (T-cell leukemia) (cluster #7 of 7) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80877-1-O | NCI-H1299 (Non-small cell lung carcinoma) (cluster #1 of 2) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-4-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #4 of 8) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81135-4-O | L6 (Skeletal muscle myoblast cells) (cluster #4 of 4) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81137-1-O | L929 (Fibroblast cells) (cluster #1 of 2) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81322-1-O | SF-539 (Glioblastoma cells) (cluster #1 of 2) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY8-1-E | Adenylate cyclase type VIII (cluster #1 of 1) | Eukaryotes | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CATD-1-E | Cathepsin D (cluster #1 of 1) | Eukaryotes | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CSF1R-1-E | Macrophage colony stimulating factor receptor (cluster #1 of 1) | Eukaryotes | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA1-4-E | GABA receptor alpha-1 subunit (cluster #4 of 5) | Eukaryotes | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM7-2-E | Metabotropic glutamate receptor 7 (cluster #2 of 2) | Eukaryotes | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDPK1-1-E | 3-phosphoinositide dependent protein kinase-1 (cluster #1 of 1) | Eukaryotes | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PEPC-1-E | Pepsinogen C (cluster #1 of 1) | Eukaryotes | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q25270-1-E | Beta tubulin (cluster #1 of 2) | Eukaryotes | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q94F81-2-E | Histone deacetylase HD2 (cluster #2 of 2) | Eukaryotes | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-4-O | Trypanosoma brucei brucei (cluster #4 of 7) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-3-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #3 of 9) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50725-4-O | Trypanosoma brucei rhodesiense (cluster #4 of 7) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80291-2-O | MRC5 (Embryonic lung fibroblast cells) (cluster #2 of 3) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80420-2-O | RBL-2H3 (Basophilic leukemia cells) (cluster #2 of 2) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80532-3-O | T-24 (Bladder carcinoma cells) (cluster #3 of 6) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80577-1-O | UT7 (cluster #1 of 1) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80657-1-O | A253 cell line (cluster #1 of 1) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81248-1-O | Malme-3M (Melanoma cells) (cluster #1 of 3) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81288-1-O | NSO (Myeloma cells) (cluster #1 of 1) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA6-1-E | Neuronal acetylcholine receptor protein alpha-6 subunit (cluster #1 of 1) | Eukaryotes | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY3-1-E | Adenylate cyclase type III (cluster #1 of 1) | Eukaryotes | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CSK-1-E | Tyrosine-protein kinase CSK (cluster #1 of 1) | Eukaryotes | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA1-3-E | Glutamate receptor ionotropic, AMPA 1 (cluster #3 of 3) | Eukaryotes | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM6-2-E | Metabotropic glutamate receptor 6 (cluster #2 of 2) | Eukaryotes | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM8-2-E | Metabotropic glutamate receptor 8 (cluster #2 of 2) | Eukaryotes | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KISSR-1-E | Metastin receptor (cluster #1 of 1) | Eukaryotes | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTP-1-E | Microsomal triglyceride transfer protein large subunit (cluster #1 of 1) | Eukaryotes | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q8X6S1-1-B | Modulator of drug activity A (cluster #1 of 1) | Bacteria | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100729-1-O | AEC (Aortic endothelial cells) (cluster #1 of 1) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50380-1-O | Mycobacterium smegmatis (cluster #1 of 4) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-2-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #2 of 9) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-4-O | Rattus norvegicus (cluster #4 of 12) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80035-2-O | B16 (Melanoma cells) (cluster #2 of 7) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80130-2-O | EJ (Bladder carcinoma cells) (cluster #2 of 2) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-5-O | HT-29 (Colon adenocarcinoma cells) (cluster #5 of 12) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80211-2-O | LoVo (Colon adenocarcinoma cells) (cluster #2 of 5) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80226-1-O | MCF7-2A (cluster #1 of 1) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80254-1-O | MES-SA (Uterine sarcoma cells) (cluster #1 of 2) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-7-O | PC-3 (Prostate carcinoma cells) (cluster #7 of 10) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80411-1-O | R30dm-CCRF-CEM (Lymphoblastic leukemia) (cluster #1 of 1) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80457-1-O | SCC-25 (cluster #1 of 1) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80459-1-O | SCC-7 (cluster #1 of 1) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80466-1-O | SF268 (cluster #1 of 4) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80466-3-O | SF268 (cluster #3 of 4) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80566-2-O | U-937 (Histiocytic lymphoma cells) (cluster #2 of 2) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-3-O | A549 (Lung carcinoma cells) (cluster #3 of 11) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80789-1-O | Colon 38 (cluster #1 of 1) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80834-1-O | EKVX (Non-small cell lung carcinoma cells) (cluster #1 of 1) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80956-1-O | HMCB cell line (cluster #1 of 1) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81186-2-O | LS174T (Colon adencocarcinoma cells) (cluster #2 of 2) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-7-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #7 of 11) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81281-1-O | NCI-H23 (Non-small cell lung carcinoma cells) (cluster #1 of 5) | Other | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA4-2-E | Neuronal acetylcholine receptor protein alpha-4 subunit (cluster #2 of 2) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1D-4-E | Alpha-1d adrenergic receptor (cluster #4 of 4) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2C-3-E | Alpha-2c adrenergic receptor (cluster #3 of 3) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH2-1-E | Carbonic anhydrase II (cluster #1 of 2) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM3-2-E | Metabotropic glutamate receptor 3 (cluster #2 of 2) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH1-2-E | Histamine H1 receptor (cluster #2 of 2) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HS90A-2-E | Heat shock protein HSP 90-alpha (cluster #2 of 3) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR3-3-E | Lysophosphatidic acid receptor Edg-7 (cluster #3 of 3) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDR3-1-E | P-glycoprotein 3 (cluster #1 of 2) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RX4-1-E | P2X purinoceptor 4 (cluster #1 of 1) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PEPA-1-E | Pepsin A (cluster #1 of 1) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q8CGM4-1-E | Mu-opioid receptor (cluster #1 of 1) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S5A1-2-E | Steroid 5-alpha-reductase 1 (cluster #2 of 2) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TTHY-1-E | Transthyretin (cluster #1 of 1) | Eukaryotes | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100084-1-O | PASMC (Porcine aorta smooth muscle cells) (cluster #1 of 1) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103205-3-O | A431 (cluster #3 of 4) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104304-1-O | Adrenergic receptor alpha-1 (cluster #1 of 1) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50422-3-O | Entamoeba histolytica (cluster #3 of 5) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-17-O | Plasmodium falciparum (cluster #17 of 22) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-6-O | Trypanosoma cruzi (cluster #6 of 8) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50468-4-O | Giardia intestinalis (cluster #4 of 4) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50501-1-O | Gallus gallus (cluster #1 of 3) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50522-2-O | unidentified influenza virus (cluster #2 of 2) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-2-O | Mus musculus (cluster #2 of 9) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80006-1-O | 3T3-L1 (Fibroblast cells) (cluster #1 of 1) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80071-2-O | CEM-0 (T-cell leukemia) (cluster #2 of 2) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80112-1-O | DAN-G (cluster #1 of 2) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80125-4-O | DU-145 (Prostate carcinoma) (cluster #4 of 9) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80140-1-O | GBM (cluster #1 of 1) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-12-O | HL-60 (Promyeloblast leukemia cells) (cluster #12 of 12) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80222-1-O | MCF-10A (cluster #1 of 1) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-3-O | P388 (Lymphoma cells) (cluster #3 of 8) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-8-O | PC-3 (Prostate carcinoma cells) (cluster #8 of 10) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80468-1-O | SF-295 (Glioblastoma cells) (cluster #1 of 2) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-6-O | A549 (Lung carcinoma cells) (cluster #6 of 11) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80840-1-O | ER22 cell line (cluster #1 of 1) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80954-2-O | HFF (Foreskin fibroblasts) (cluster #2 of 4) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-4-O | HeLa (Cervical adenocarcinoma cells) (cluster #4 of 9) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81283-1-O | NCI-H522 (Non-small cell lung carcinoma cells) (cluster #1 of 2) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AKT1-1-E | Serine/threonine-protein kinase AKT (cluster #1 of 1) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BCR-1-E | Breakpoint cluster region protein (cluster #1 of 2) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1I-1-E | Voltage-gated T-type calcium channel alpha-1I subunit (cluster #1 of 1) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA5-3-E | GABA receptor alpha-5 subunit (cluster #3 of 4) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM5-5-E | Metabotropic glutamate receptor 5 (cluster #5 of 5) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GSK3A-1-E | Glycogen synthase kinase-3 alpha (cluster #1 of 1) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH4-2-E | Histamine H4 receptor (cluster #2 of 2) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NEP-1-E | Neprilysin (cluster #1 of 1) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| O77823-1-E | Phosphodiesterase 4A (cluster #1 of 1) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9RMS5-1-B | PhzR (cluster #1 of 1) | Bacteria | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RXRG-2-E | Retinoid X receptor gamma (cluster #2 of 2) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SSR5-1-E | Somatostatin receptor 5 (cluster #1 of 1) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TERT-1-E | Telomerase reverse transcriptase (cluster #1 of 1) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100507-1-O | CEM/C2 (Camptothecin-resistant CEM cells) (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102342-1-O | Liver (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50185-4-O | Staphylococcus aureus (cluster #4 of 4) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50270-1-O | Bacillus licheniformis (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50339-1-O | Pneumocystis carinii (cluster #1 of 2) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-16-O | Plasmodium falciparum (cluster #16 of 22) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-2-O | Leishmania donovani (cluster #2 of 8) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50474-1-O | Plasmodium yoelii (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-6-O | Oryctolagus cuniculus (cluster #6 of 8) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80035-5-O | B16 (Melanoma cells) (cluster #5 of 7) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80036-2-O | BaF3 (IL-3-dependent pro-B-cells) (cluster #2 of 3) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-10-O | MCF7 (Breast carcinoma cells) (cluster #10 of 14) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80316-1-O | NCI-H128 (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80357-1-O | OVCAR-8 (Ovarian adenocarcinoma cells) (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80462-1-O | SCLC (Small cell lung carcinoma cells) (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80471-2-O | SH-SY5 (Bone marrow neuroblastoma cells) (cluster #2 of 3) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80783-1-O | COLO1 (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81021-1-O | Human hepatoma cell line (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81117-1-O | Keratinocytes (Keratinocytes) (cluster #1 of 2) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81131-1-O | L cells (Fibroblasts) (cluster #1 of 1) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81186-1-O | LS174T (Colon adencocarcinoma cells) (cluster #1 of 2) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AURKA-1-E | Serine/threonine-protein kinase Aurora-A (cluster #1 of 1) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| B2CL1-1-E | Apoptosis regulator Bcl-X (cluster #1 of 1) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BACE2-1-E | Beta secretase 2 (cluster #1 of 1) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CDK4-1-E | Cyclin-dependent kinase 4 (cluster #1 of 1) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CDN1A-1-E | CDK-interacting protein 1 (cluster #1 of 1) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DYR-1-B | Dihydrofolate reductase (cluster #1 of 1) | Bacteria | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FCER2-1-E | Immunoglobulin epsilon Fc receptor (cluster #1 of 1) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FYN-1-E | Tyrosine-protein kinase FYN (cluster #1 of 1) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA6-3-E | GABA receptor alpha-6 subunit (cluster #3 of 4) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH2-1-E | Histamine H2 receptor (cluster #1 of 2) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HS90A-3-E | Heat shock protein HSP 90-alpha (cluster #3 of 3) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HS90B-3-E | Heat shock protein HSP 90-beta (cluster #3 of 3) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNH2-2-E | HERG (cluster #2 of 2) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KINA-1-B | Sporulation kinase A (cluster #1 of 1) | Bacteria | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR1-3-E | Lysophosphatidic acid receptor Edg-2 (cluster #3 of 4) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR2-2-E | Lysophosphatidic acid receptor Edg-4 (cluster #2 of 4) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMD3B-1-E | Glutamate [NMDA] receptor subunit 3B (cluster #1 of 2) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RX5-1-E | P2X purinoceptor 5 (cluster #1 of 1) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RX6-1-E | P2X purinoceptor 6 (cluster #1 of 1) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE1B-2-E | Phosphodiesterase 1B (cluster #2 of 2) | Eukaryotes | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SP0F-1-B | Sporulation initiation phosphotransferase F (cluster #1 of 1) | Bacteria | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100766-1-O | Radical scavenging activity (cluster #1 of 2) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103204-2-O | A427 (cluster #2 of 4) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50380-2-O | Mycobacterium smegmatis (cluster #2 of 4) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50418-1-O | Trypanosoma brucei (cluster #1 of 6) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-4-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #4 of 9) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50573-1-O | Xenopus laevis (cluster #1 of 2) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50652-1-O | Influenza A virus (cluster #1 of 4) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80024-3-O | A9 (Fibroblast cells) (cluster #3 of 3) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80053-1-O | CA46 (Burkitts lymphoma cells) (cluster #1 of 1) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80110-2-O | CV-1 (Kidney cells) (cluster #2 of 2) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80331-1-O | N2a (Neuroblastoma cells) (cluster #1 of 1) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80356-1-O | OVCAR-5 (Ovarian adenocarcinoma cells) (cluster #1 of 2) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80401-1-O | PSN1 (cluster #1 of 2) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80491-2-O | SK-N-MC (Neuroepithelioma cells) (cluster #2 of 4) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-1-O | T47D (Breast carcinoma cells) (cluster #1 of 7) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80737-1-O | C3H/3T3 (Embryonic fibroblast cells) (cluster #1 of 1) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80904-1-O | HB4a (cluster #1 of 1) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80933-1-O | HEY (Ovarian carcinoma cells) (cluster #1 of 1) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80936-2-O | HEK293 (Embryonic kidney fibroblasts) (cluster #2 of 4) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80942-1-O | HEL (Embryonic lung cells) (cluster #1 of 2) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81074-1-O | K177cell line (cluster #1 of 1) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1D-2-E | Serotonin 1d (5-HT1d) receptor (cluster #2 of 2) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY4-1-E | Adenylate cyclase type IV (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY6-1-E | Adenylate cyclase type VI (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BCL2-1-E | Apoptosis regulator Bcl-2 (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| C11B2-1-E | Cytochrome P450 11B2 (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH4-1-E | Carbonic anhydrase IV (cluster #1 of 2) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CATE-1-E | Cathepsin E (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK1-2-E | Glutamate receptor ionotropic kainate 1 (cluster #2 of 2) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM1-3-E | Metabotropic glutamate receptor 1 (cluster #3 of 5) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GYS1-1-E | Muscle glycogen synthase (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IKKA-1-E | Inhibitor of nuclear factor kappa B kinase alpha subunit (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITPR2-1-E | Inositol 1,4,5-trisphosphate receptor type 2 (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITPR3-1-E | Inositol 1,4,5-trisphosphate receptor type 3 (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| JAK1-1-E | Tyrosine-protein kinase JAK1 (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KAPCA-1-E | cAMP-dependent protein kinase alpha-catalytic subunit (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KAPCB-1-E | cAMP-dependent protein kinase beta-1 catalytic subunit (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KAPCG-1-E | cAMP-dependent protein kinase, gamma catalytic subunit (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDM2-1-E | p53-binding protein Mdm-2 (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NEMO-1-E | NF-kappa-B essential modulator (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NTR1-1-E | Neurotensin receptor 1 (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE1B-1-E | Phosphodiesterase 1B (cluster #1 of 2) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE1C-2-E | Phosphodiesterase 1C (cluster #2 of 2) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PNPH-1-E | Purine nucleoside phosphorylase (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q8CFM9-1-E | Adenylate cyclase type VII (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9EPR9-1-E | Phosphodiesterase 1A (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9R297-1-E | Thyrotropin-releasing hormone receptor 2 (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RET4-1-E | Plasma retinol-binding protein (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPA1-3-E | Transient receptor potential cation channel subfamily A member 1 (cluster #3 of 6) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TYSY-1-E | Thymidylate synthase (cluster #1 of 1) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100274-1-O | Liposome (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100489-1-O | eosinophils (Eosinophils) (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102013-2-O | Plasmodium malariae (cluster #2 of 2) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102116-1-O | Toxoplasma gondii RH (cluster #1 of 2) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102352-3-O | Plasma (cluster #3 of 3) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104285-1-O | Neuronal acetylcholine receptor; alpha4/beta4 (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104289-1-O | Neuronal acetylcholine receptor; alpha4/beta4 (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50418-6-O | Trypanosoma brucei (cluster #6 of 6) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-7-O | Trypanosoma cruzi (cluster #7 of 8) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50472-2-O | Toxoplasma gondii (cluster #2 of 4) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-3-O | Cavia porcellus (cluster #3 of 7) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-9-O | Human immunodeficiency virus 1 (cluster #9 of 10) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50665-1-O | Enterovirus (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-7-O | L1210 (Lymphocytic leukemia cells) (cluster #7 of 12) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-12-O | MCF7 (Breast carcinoma cells) (cluster #12 of 14) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80270-1-O | MKN-5 (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80322-2-O | NCI-H358 (Lung carcinama cells) (cluster #2 of 2) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80417-1-O | RAW (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80433-1-O | RPMI-8226 (Multiple myeloma cells) (cluster #1 of 3) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80441-1-O | RXF 944 (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80452-1-O | SBC-5 (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80471-1-O | SH-SY5 (Bone marrow neuroblastoma cells) (cluster #1 of 3) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80482-3-O | SK-MEL-2 (Melanoma cells) (cluster #3 of 4) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80568-1-O | UACC-257 (Melanoma cells) (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80570-3-O | UACC-62 (Melanoma cells) (cluster #3 of 3) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80575-1-O | UO-31 (Renal carcinoma cells) (cluster #1 of 3) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80608-1-O | ZR-75-1 (Breast carcinoma cells) (cluster #1 of 4) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80823-1-O | E6SM (Embryonic skin-muscle fibroblast cells) (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80860-1-O | GC3/M cell line (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81006-1-O | Human breast 401NL tumor cell line (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81025-1-O | Human lung LXF 529L tumor cell line (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81026-1-O | Human lung LXF 629L tumor cell line (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-7-O | Jurkat (Acute leukemic T-cells) (cluster #7 of 10) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81205-1-O | Lvec cell line (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81245-2-O | MDA-MB-435 (Breast carcinoma cells) (cluster #2 of 6) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81285-1-O | NIH-H cell line (cluster #1 of 1) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHD-1-E | Acetylcholine receptor protein delta chain (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| C3AR-1-E | C3a anaphylatoxin chemotactic receptor (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CXCR1-1-E | Interleukin-8 receptor A (cluster #1 of 2) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CXCR2-1-E | C-X-C chemokine receptor type 2 (cluster #1 of 3) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HNF4A-1-E | Hepatocyte nuclear factor 4-alpha (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| JAK2-1-E | Tyrosine-protein kinase JAK2 (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KSYK-1-E | Tyrosine-protein kinase SYK (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LCK-1-E | Tyrosine-protein kinase LCK (cluster #1 of 2) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LUXP-2-B | Autoinducer 2-binding periplasmic protein luxP (cluster #2 of 2) | Bacteria | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MP2K1-1-E | Dual specificity mitogen-activated protein kinase kinase 1 (cluster #1 of 2) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MP2K2-1-E | Dual specificity mitogen-activated protein kinase kinase 2 (cluster #1 of 2) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTR1C-1-E | Melatonin receptor 1C (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE1A-1-E | Phosphodiesterase 1A (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE1C-1-E | Phosphodiesterase 1C (cluster #1 of 2) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRXR1-1-E | Thioredoxin reductase 1 (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRXR2-1-E | Thioredoxin reductase 2 (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRXR3-1-E | Thioredoxin reductase 3 (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100081-3-O | PBMC (Peripheral blood mononuclear cells) (cluster #3 of 4) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100499-1-O | SARS coronavirus (cluster #1 of 2) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100748-1-O | Neutrophils (cluster #1 of 2) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102256-1-O | Plasma (cluster #1 of 1) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103204-1-O | A427 (cluster #1 of 4) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50145-1-O | Enterobacter cloacae (cluster #1 of 1) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50417-3-O | Leishmania infantum (cluster #3 of 4) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-5-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #5 of 9) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50452-1-O | Trichophyton rubrum (cluster #1 of 2) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50523-1-O | Influenza B virus (cluster #1 of 1) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50588-6-O | Canis familiaris (cluster #6 of 7) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50593-1-O | Gerbillinae (cluster #1 of 1) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50725-2-O | Trypanosoma brucei rhodesiense (cluster #2 of 7) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80054-4-O | Caco-2 (Colon adenocarcinoma cells) (cluster #4 of 4) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80094-1-O | CHO-MG (Ovarian cells) (cluster #1 of 1) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80119-1-O | Detroit 98 (cluster #1 of 1) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80145-3-O | H69 (cluster #3 of 4) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80178-1-O | J774.A1 (Macrophage cells) (cluster #1 of 3) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-4-O | L1210 (Lymphocytic leukemia cells) (cluster #4 of 12) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80255-2-O | MES-SA/DxS (Uterine sarcoma cells) (cluster #2 of 2) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-8-O | MT4 (Lymphocytes) (cluster #8 of 8) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-7-O | P388 (Lymphoma cells) (cluster #7 of 8) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80364-1-O | P388/ADR (Lymphoma cells) (cluster #1 of 1) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80381-1-O | PANC-1 (Pancreatic carcinoma cells) (cluster #1 of 1) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80418-1-O | RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #1 of 9) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80418-7-O | RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #7 of 9) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80485-3-O | SK-MEL-28 (Melanoma cells) (cluster #3 of 6) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80492-2-O | SK-N-SH (Neuroblastoma cells) (cluster #2 of 2) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80559-1-O | U251 (cluster #1 of 3) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80560-1-O | U-251 (Glioma cells) (cluster #1 of 3) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-9-O | A549 (Lung carcinoma cells) (cluster #9 of 11) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80697-1-O | Bel-7402 (Hepatoma cells) (cluster #1 of 3) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-6-O | T47D (Breast carcinoma cells) (cluster #6 of 7) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80784-1-O | Col2 (Colon carcinoma cells) (cluster #1 of 2) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80852-2-O | A-431 (Epidermoid carcinoma cells) (cluster #2 of 3) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-4-O | HCT-116 (Colon carcinoma cells) (cluster #4 of 9) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80945-2-O | HEp-2 (Laryngeal carcinoma cells) (cluster #2 of 4) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-5-O | HepG2 (Hepatoblastoma cells) (cluster #5 of 8) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81047-1-O | Human T-cell line (cluster #1 of 2) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81246-2-O | MDA-N (Breast carcinoma cells) (cluster #2 of 2) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-10-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #10 of 11) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ABL1-2-E | Tyrosine-protein kinase ABL (cluster #2 of 2) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACH10-1-E | Neuronal acetylcholine receptor protein alpha-10 subunit (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA9-1-E | Neuronal acetylcholine receptor protein alpha-9 subunit (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1D-2-E | Alpha-1d adrenergic receptor (cluster #2 of 4) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2A-1-E | Alpha-2a adrenergic receptor (cluster #1 of 3) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2B-1-E | Alpha-2b adrenergic receptor (cluster #1 of 3) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2C-1-E | Alpha-2c adrenergic receptor (cluster #1 of 3) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADRB2-2-E | Beta-2 adrenergic receptor (cluster #2 of 2) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BCR-2-E | Breakpoint cluster region protein (cluster #2 of 2) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAN2-1-E | Calpain 2 (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CPNS1-1-E | Calpain small subunit 1 (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DPP4-1-E | Dipeptidyl peptidase IV (cluster #1 of 2) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FOLH1-1-E | Glutamate carboxypeptidase II (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR1-1-E | GABA receptor rho-1 subunit (cluster #1 of 4) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMD3A-1-E | Glutamate [NMDA] receptor subunit 3A (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDK1-1-E | Pyruvate dehydrogenase kinase isoform 1 (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDK2-1-E | Pyruvate dehydrogenase kinase isoform 2 (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDK3-1-E | Pyruvate dehydrogenase kinase isoform 3 (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDK4-1-E | Pyruvate dehydrogenase kinase isoform 4 (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q5HMD9-1-B | UDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase (cluster #1 of 1) | Bacteria | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN7A-1-E | Sodium channel protein type VII alpha subunit (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRFR-1-E | Thyrotropin-releasing hormone receptor (cluster #1 of 1) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100515-1-O | HPAC (Pancreatic adenocarcinoma) (cluster #1 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100709-1-O | Squirrel monkey (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100741-2-O | MC9 (Mast cells) (cluster #2 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102191-1-O | Blood (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102380-2-O | Ileum (cluster #2 of 3) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50142-2-O | Influenza A virus (A/PR/8/34(H1N1)) (cluster #2 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50212-7-O | Escherichia coli (cluster #7 of 7) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50416-1-O | Aspergillus fumigatus (cluster #1 of 3) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50417-1-O | Leishmania infantum (cluster #1 of 4) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50422-1-O | Entamoeba histolytica (cluster #1 of 5) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50422-5-O | Entamoeba histolytica (cluster #5 of 5) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-8-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #8 of 9) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-3-O | Leishmania donovani (cluster #3 of 8) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-5-O | Leishmania donovani (cluster #5 of 8) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50460-1-O | Leishmania major (cluster #1 of 4) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-3-O | Trypanosoma cruzi (cluster #3 of 8) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-5-O | Trypanosoma cruzi (cluster #5 of 8) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50473-4-O | Plasmodium berghei (cluster #4 of 5) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50573-2-O | Xenopus laevis (cluster #2 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-8-O | Mus musculus (cluster #8 of 9) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50599-1-O | Cowpox virus (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50740-2-O | Cricetinae gen. sp. (cluster #2 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50759-1-O | Dictyostelium discoideum (cluster #1 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80019-1-O | A-427 (Lung carcinoma cells) (cluster #1 of 4) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80021-2-O | A498 (Renal carcinoma cells) (cluster #2 of 5) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80047-1-O | Beta-TC3 (Insulinoma cells) (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-6-O | CCRF-CEM (T-cell leukemia) (cluster #6 of 9) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80099-3-O | COLO 205 (Colon adenocarcinoma cells) (cluster #3 of 3) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80101-2-O | COLO 320DM (Colon adenocarcinoma cells) (cluster #2 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80114-3-O | Daudi (Burkitts lymphoma cells) (cluster #3 of 4) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80132-1-O | EL4 (Thymoma cells) (cluster #1 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-10-O | HL-60 (Promyeloblast leukemia cells) (cluster #10 of 12) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80164-4-O | HT-1080 (Fibrosarcoma cells) (cluster #4 of 6) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80199-1-O | L1210 (R7A) (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80211-3-O | LoVo (Colon adenocarcinoma cells) (cluster #3 of 5) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80236-1-O | MCR (Frog skin melanocyte cells) (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80277-1-O | MM96L (Melanoma cells) (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80306-1-O | NB-4 (Promyelocytic leukemia cells) (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80335-1-O | NHDF (cluster #1 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80347-2-O | NUGC-3 (Gastric carcinoma cells) (cluster #2 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-8-O | P388 (Lymphoma cells) (cluster #8 of 8) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80443-1-O | S180 (Sarcoma cells) (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80473-1-O | SISO (cluster #1 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80488-1-O | SK-MEL-5 (Melanoma cells) (cluster #1 of 3) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80491-3-O | SK-N-MC (Neuroepithelioma cells) (cluster #3 of 4) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80525-2-O | SW48 (cluster #2 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80686-1-O | AZ-521 cell line (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80893-1-O | H35 (Reuber hepatoma cells) (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80895-1-O | NCI-H596 (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80920-1-O | HCC 2998 (Colon adenocarcinoma cells) (cluster #1 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80947-1-O | Hepatoblastoma cell line (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80954-4-O | HFF (Foreskin fibroblasts) (cluster #4 of 4) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81065-3-O | IGROV-1 (Ovarian adenocarcinoma cells) (cluster #3 of 3) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81115-3-O | KB (Squamous cell carcinoma) (cluster #3 of 6) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81121-1-O | KKLS cell line (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81135-3-O | L6 (Skeletal muscle myoblast cells) (cluster #3 of 4) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-6-O | HeLa (Cervical adenocarcinoma cells) (cluster #6 of 9) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81325-1-O | SR (Leukemia cells) (cluster #1 of 2) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81330-1-O | SNU- (cluster #1 of 1) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81335-3-O | HCT-15 (Colon adenocarcinoma cells) (cluster #3 of 5) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AAPK1-1-E | AMP-activated protein kinase, alpha-1 subunit (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AAPK2-1-E | AMP-activated protein kinase, alpha-2 subunit (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA-1-E | Acetylcholine receptor protein alpha chain (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA4-1-E | Neuronal acetylcholine receptor protein alpha-4 subunit (cluster #1 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY1-1-E | Brain adenylate cyclase 1 (cluster #1 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AHR-1-E | Aryl hydrocarbon receptor (cluster #1 of 3) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BLAT-1-B | Beta-lactamase TEM (cluster #1 of 1) | Bacteria | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CD22-1-E | B-cell receptor CD22 (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CDK1-1-E | Cyclin-dependent kinase 1 (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CP19A-1-E | Cytochrome P450 19A1 (cluster #1 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DHB2-1-E | Estradiol 17-beta-dehydrogenase 2 (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERR3-2-E | Estrogen-related receptor gamma (cluster #2 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK2-2-E | Glutamate receptor ionotropic kainate 2 (cluster #2 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GYRA-1-B | DNA gyrase subunit A (cluster #1 of 1) | Bacteria | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GYRB-1-B | DNA gyrase subunit B (cluster #1 of 1) | Bacteria | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HELD-1-B | Helicase IV (cluster #1 of 1) | Bacteria | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HS90B-2-E | Heat shock protein HSP 90-beta (cluster #2 of 3) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LUXP-1-B | Autoinducer 2-binding periplasmic protein luxP (cluster #1 of 2) | Bacteria | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2Y11-1-E | Purinergic receptor P2Y11 (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PAI1-1-E | Plasminogen activator inhibitor-1 (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PARC-1-B | Topoisomerase IV subunit A (cluster #1 of 1) | Bacteria | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S1PR2-1-E | Sphingosine 1-phosphate receptor Edg-5 (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S5A1-1-E | Steroid 5-alpha-reductase 1 (cluster #1 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S5A2-1-E | Steroid 5-alpha-reductase 2 (cluster #1 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN1B-1-E | Sodium channel beta-1 subunit (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN2B-1-E | Sodium channel beta-2 subunit (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN3B-1-E | Sodium channel beta-3 subunit (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN4A-1-E | Sodium channel protein type IV alpha subunit (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN4B-1-E | Sodium channel beta-4 subunit (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| STS-1-E | Steryl-sulfatase precursor (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TNFA-2-E | TNF-alpha (cluster #2 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| XIAP-1-E | Inhibitor of apoptosis protein 3 (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100201-1-O | Splenocytes (Spleen cells) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100497-1-O | Bovine viral diarrhea virus (cluster #1 of 3) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101794-1-O | Felid herpesvirus 1 (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101822-1-O | H3N2 subtype (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101973-1-O | Paracentrotus lividus (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102121-2-O | Trichophyton mentagrophytes (cluster #2 of 3) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102240-1-O | Cartilage (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102306-4-O | Aorta (cluster #4 of 6) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102317-2-O | Brain (cluster #2 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50208-1-O | Citrobacter freundii (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50408-1-O | Issatchenkia orientalis (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50443-1-O | Candida glabrata (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50457-1-O | Leishmania amazonensis (cluster #1 of 3) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50460-2-O | Leishmania major (cluster #2 of 4) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50522-1-O | unidentified influenza virus (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-9-O | Rattus norvegicus (cluster #9 of 12) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-5-O | Human immunodeficiency virus 1 (cluster #5 of 10) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50641-1-O | West Nile virus (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50658-4-O | Human immunodeficiency virus 2 (cluster #4 of 4) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50797-1-O | Rhesus monkey (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80002-1-O | 1A9 (Ovarian adenocarcinoma cells) (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80012-1-O | A 172 (Glioblastoma cells) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80021-3-O | A498 (Renal carcinoma cells) (cluster #3 of 5) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80033-1-O | AtT20 (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-7-O | CCRF-CEM (T-cell leukemia) (cluster #7 of 9) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-8-O | CCRF-CEM (T-cell leukemia) (cluster #8 of 9) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80120-3-O | DLD-1 (Colon adenocarcinoma cells) (cluster #3 of 5) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80125-2-O | DU-145 (Prostate carcinoma) (cluster #2 of 9) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80138-1-O | G-361 (Melanoma cells) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80164-2-O | HT-1080 (Fibrosarcoma cells) (cluster #2 of 6) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80164-6-O | HT-1080 (Fibrosarcoma cells) (cluster #6 of 6) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-10-O | HT-29 (Colon adenocarcinoma cells) (cluster #10 of 12) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-10-O | K562 (Erythroleukemia cells) (cluster #10 of 11) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80214-1-O | M14 (Melanoma cells) (cluster #1 of 3) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80231-1-O | MCF7S (Breast carcinoma cells) (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-1-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #1 of 7) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80267-1-O | MKN-1 (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80268-2-O | MKN-28 (Gastric epithelial carcinoma cells) (cluster #2 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80269-3-O | MKN-45 (Gastric adenocarcinoma cells) (cluster #3 of 3) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80322-1-O | NCI-H358 (Lung carcinama cells) (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80332-1-O | NFF (Fibroblast cells) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-4-O | P388 (Lymphoma cells) (cluster #4 of 8) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80389-1-O | PC-14 (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80408-1-O | R1-CCRF-CEM (Lymphoblastic leukemia) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80438-1-O | RXF 393 (Renal carcinoma cells) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80482-1-O | SK-MEL-2 (Melanoma cells) (cluster #1 of 4) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80509-1-O | SNU-638 (Gastric carcinoma cells) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80530-1-O | Swiss-3T3 (Fibroblast cells) (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80532-4-O | T-24 (Bladder carcinoma cells) (cluster #4 of 6) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80558-1-O | U11 MG (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80604-1-O | YAPC (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80720-1-O | Burkitts lymphoma cells (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80725-1-O | C180-13S (Ovarian carcinoma cells) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80751-1-O | Caov-3 cell line (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80798-1-O | CPT30 cell line (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80815-1-O | D54 cell line (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80819-1-O | J774.2 (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80830-1-O | Ehrlich (Ehrlich ascites carcinoma cells) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80857-1-O | Friend leukemia cell line (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80874-4-O | CEM (T-cell leukemia) (cluster #4 of 7) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80896-1-O | NCI-H69 (Small cell lung carcinoma cells) (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80900-1-O | HA22T cell line (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80952-1-O | HES (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80967-2-O | Hone-1 cell line (cluster #2 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80991-1-O | Hs-578T (Breast carcinoma cells) (cluster #1 of 3) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81028-1-O | Human melanoma cell line (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81048-1-O | TSU (Prostatic carcinoma cells) (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81057-3-O | HUVEC (Umbilical vein endothelial cells) (cluster #3 of 4) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81080-1-O | KATO-III cell line (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81125-1-O | KU812 cell line (cluster #1 of 1) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81170-4-O | LNCaP (Prostate carcinoma) (cluster #4 of 5) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-2-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #2 of 11) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH1-1-E | Carbonic anhydrase I (cluster #1 of 3) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| D4A3N4-1-E | Brain adenylate cyclase 1 (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ECE1-1-E | Endothelin-converting enzyme 1 (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR1-4-E | GABA receptor rho-1 subunit (cluster #4 of 4) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLRA1-1-E | Glycine receptor subunit alpha-1 (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNN1-2-E | Small conductance calcium-activated potassium channel protein 1 (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNN2-2-E | Small conductance calcium-activated potassium channel protein 2 (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNN3-2-E | Small conductance calcium-activated potassium channel protein 3 (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCA-1-E | Protein kinase C alpha (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCD-1-E | Protein kinase C delta (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCD1-1-E | Protein kinase C mu (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCD3-1-E | Protein kinase C nu (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCE-1-E | Protein kinase C epsilon (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCG-1-E | Protein kinase C gamma (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCL-1-E | Protein kinase C eta (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCT-1-E | Protein kinase C theta (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR2-4-E | Lysophosphatidic acid receptor Edg-4 (cluster #4 of 4) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR3-2-E | Lysophosphatidic acid receptor Edg-7 (cluster #2 of 3) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LYAM2-1-E | Selectin E (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MMP2-1-E | Matrix metalloproteinase-2 (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| O46128-1-E | Nicotinic acetylcholine receptor alpha1 subunit (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R1-2-E | Prostanoid EP1 receptor (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R3-2-E | Prostanoid EP3 receptor (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARA-2-E | Peroxisome proliferator-activated receptor alpha (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PTGR1-1-E | NADP-dependent leukotriene B4 12-hydroxydehydrogenase (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S5A2-2-E | Steroid 5-alpha-reductase 2 (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TLR4-2-E | Toll-like receptor 4 (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TLR9-1-E | Toll-like receptor 9 (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TS1R2-1-E | Taste receptor type 1 member 2 (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TS1R3-1-E | Taste receptor type 1 member 3 (cluster #1 of 1) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| US28-1-V | Human herpesvirus 5 chemokine receptor (cluster #1 of 1) | Viruses | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100508-1-O | CWR22R (Prostate carcinoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100517-1-O | Hs 766 (Pancreatic carcinoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100522-1-O | LAPC4 (Prostate carcinoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100727-1-O | A20 (Sarcoma B-lymphocytes) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100742-1-O | MeWo (Melanoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100811-1-O | Influenza A virus (H5N1) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101682-1-O | BK polyomavirus (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101821-1-O | H2N2 subtype (cluster #1 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103196-1-O | 22RV1 (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103205-2-O | A431 (cluster #2 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103208-1-O | AU565 (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103267-1-O | H4 (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103342-1-O | NCI-H1993 (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104302-2-O | Glutamate NMDA receptor (cluster #2 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50046-1-O | Trichophyton quinckeanum (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50309-1-O | Mycobacterium tuberculosis (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50378-1-O | Mycobacterium intracellulare (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50409-1-O | Kluyveromyces marxianus (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50422-4-O | Entamoeba histolytica (cluster #4 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-7-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #7 of 9) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50436-1-O | Filobasidiella neoformans (cluster #1 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-8-O | Leishmania donovani (cluster #8 of 8) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50460-4-O | Leishmania major (cluster #4 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50461-1-O | Leishmania mexicana (cluster #1 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50473-3-O | Plasmodium berghei (cluster #3 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-7-O | Cavia porcellus (cluster #7 of 7) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50515-2-O | Human herpesvirus 2 (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50517-1-O | Human herpesvirus 5 strain AD169 (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50527-2-O | Human herpesvirus 3 (cluster #2 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50527-3-O | Human herpesvirus 3 (cluster #3 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-7-O | Homo sapiens (cluster #7 of 9) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50602-1-O | Human herpesvirus 1 (cluster #1 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50604-1-O | Murid herpesvirus 1 (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50641-2-O | West Nile virus (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50651-2-O | Vesicular stomatitis virus (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50652-2-O | Influenza A virus (cluster #2 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50674-1-O | Human rhinovirus 2 (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50678-2-O | Respiratory syncytial virus (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80005-2-O | 3T3 (Fibroblast cells) (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80014-1-O | A204 (Rhabdomyosarcoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80056-1-O | CAKI-2 (Renal carcinoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80077-1-O | CEM-TK(-) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80088-3-O | CHO (Ovarian cells) (cluster #3 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80109-1-O | CTLL (Cytotoxic T-cells) (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80183-1-O | JM1 (B-cell leukemia cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-3-O | K562 (Erythroleukemia cells) (cluster #3 of 11) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-5-O | K562 (Erythroleukemia cells) (cluster #5 of 11) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-6-O | L1210 (Lymphocytic leukemia cells) (cluster #6 of 12) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-3-O | MCF7 (Breast carcinoma cells) (cluster #3 of 14) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80249-1-O | MDCK (Kidney cells) (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80347-1-O | NUGC-3 (Gastric carcinoma cells) (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80387-3-O | PC-12 (Adrenal phaeochromacytoma cells) (cluster #3 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80410-1-O | R2-CCRF-CEM (Lymphoblastic leukemia) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80419-2-O | RBL-1 (Basophilic leukemia cells) (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80471-3-O | SH-SY5 (Bone marrow neuroblastoma cells) (cluster #3 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80513-1-O | SQ20B (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80526-2-O | SW480 (Colon adenocarcinoma cells) (cluster #2 of 6) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80548-2-O | THP-1 (Acute monocytic leukemia cells) (cluster #2 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80661-1-O | A704 (Renal carcinoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80678-1-O | AMML cell line (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-3-O | T47D (Breast carcinoma cells) (cluster #3 of 7) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80777-1-O | CML/BC cell line (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80799-1-O | RPMI 8402 (Pre-T-lymphoblastoid cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80863-1-O | GC3M(-) cell line (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80936-4-O | HEK293 (Embryonic kidney fibroblasts) (cluster #4 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80994-1-O | SJSA (Astrocytoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80996-1-O | HT1197 (Bladder carcinoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-2-O | Jurkat (Acute leukemic T-cells) (cluster #2 of 10) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-3-O | Jurkat (Acute leukemic T-cells) (cluster #3 of 10) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81167-1-O | LLTC cell line (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81170-3-O | LNCaP (Prostate carcinoma) (cluster #3 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81221-1-O | Lymphoma cell line (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81225-1-O | M109 (Lung carcinoma cells) (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-5-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #5 of 11) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81316-1-O | BT-549 (Breast ductal carcinoma cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ABL2-1-E | Tyrosine-protein kinase ABL2 (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AHR-3-E | Aryl hydrocarbon receptor (cluster #3 of 3) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ALK-1-E | ALK tyrosine kinase receptor (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AOFA-1-E | Monoamine oxidase A (cluster #1 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AREG-1-E | Amphiregulin (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ARP19-1-E | cyclic AMP phosphoprotein (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH1-3-E | Carbonic anhydrase I (cluster #3 of 3) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CATK-1-E | Cathepsin K (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERBB4-1-E | Receptor protein-tyrosine kinase erbB-4 (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERG7-1-E | Lanosterol synthase (cluster #1 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERR3-1-E | Estrogen-related receptor gamma (cluster #1 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GABR1-1-E | GABA-B receptor 1 (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB1-2-E | GABA receptor beta-1 subunit (cluster #2 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRD-1-E | GABA receptor delta subunit (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG1-1-E | GABA receptor gamma-1 subunit (cluster #1 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GPER-1-E | G-protein coupled estrogen receptor 1 (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HCAR3-1-E | HM74 nicotinic acid GPCR (cluster #1 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH2-2-E | Histamine H2 receptor (cluster #2 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNA1-1-E | Voltage-gated potassium channel subunit Kv1.1 (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNA2-1-E | Voltage-gated potassium channel subunit Kv1.2 (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KITH-1-E | Thymidine kinase (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOS1-2-E | Nitric-oxide synthase, brain (cluster #2 of 3) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOS2-1-E | Nitric oxide synthase, inducible (cluster #1 of 3) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOS3-1-E | Nitric-oxide synthase, endothelial (cluster #1 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NPM-1-E | Nucleophosmin (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| O70424-1-E | Neuropeptide Y-Y2 receptor (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PUR2-1-E | GAR transformylase (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q25270-2-E | Beta tubulin (cluster #2 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RAF1-2-E | Serine/threonine-protein kinase RAF (cluster #2 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A11-2-E | GABA transporter 3 (cluster #2 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A13-2-E | GABA transporter 2 (cluster #2 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| STF1-1-E | Steroidogenic factor 1 (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPA1-5-E | Transient receptor potential cation channel subfamily A member 1 (cluster #5 of 6) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100085-1-O | DMS-114 (Lung carcinoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100088-1-O | Skut1B (Rb positve sarcoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100091-1-O | HS27 (Fibroblast cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100094-1-O | MLF (Lung fibroblast cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100495-1-O | BMEC (Brain microvessel endothelial cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100499-2-O | SARS coronavirus (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100689-1-O | Osteoblasts (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100692-1-O | Panc430 (Pancreatic carcinoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100732-1-O | CNE (Nasopharyngeal carcinoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100741-1-O | MC9 (Mast cells) (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101822-2-O | H3N2 subtype (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101849-2-O | Human papillomavirus type 16 (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101865-1-O | Leishmania chagasi (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102020-1-O | Porcine endogenous retrovirus (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103204-3-O | A427 (cluster #3 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103216-1-O | C32 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104301-2-O | GABA-A receptor; anion channel (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50212-2-O | Escherichia coli (cluster #2 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50212-3-O | Escherichia coli (cluster #3 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50417-2-O | Leishmania infantum (cluster #2 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50418-3-O | Trypanosoma brucei (cluster #3 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-3-O | Trypanosoma brucei brucei (cluster #3 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-7-O | Trypanosoma brucei brucei (cluster #7 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-12-O | Plasmodium falciparum (cluster #12 of 22) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-13-O | Plasmodium falciparum (cluster #13 of 22) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50442-2-O | Candida albicans (cluster #2 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50444-1-O | Candida parapsilosis (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50460-3-O | Leishmania major (cluster #3 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50467-3-O | Trichomonas vaginalis (cluster #3 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50530-3-O | Human herpesvirus 5 (cluster #3 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50531-3-O | Caenorhabditis elegans (cluster #3 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50589-1-O | Felis catus (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50589-2-O | Felis catus (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-5-O | Oryctolagus cuniculus (cluster #5 of 8) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50600-2-O | Vaccinia virus (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50602-3-O | Human herpesvirus 1 (cluster #3 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50611-2-O | Moloney murine leukemia virus (cluster #2 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50651-1-O | Vesicular stomatitis virus (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50658-2-O | Human immunodeficiency virus 2 (cluster #2 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50666-1-O | Coxsackievirus (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50731-1-O | Echovirus (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50740-1-O | Cricetinae gen. sp. (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80001-1-O | 143B (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80024-1-O | A9 (Fibroblast cells) (cluster #1 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80040-1-O | BHK-21 (Kidney cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80045-1-O | BT-20 (Breast carcinoma cells) (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80048-1-O | BXPC-3 (Pancreatic adenocarcinoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-2-O | CCRF-CEM (T-cell leukemia) (cluster #2 of 9) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80068-1-O | CCRF-SB (Lymphoblastic leukemia cells) (cluster #1 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80086-1-O | CFPAC-1 (Pancreatic carcinoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80089-1-O | CHO-AA8 (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80111-1-O | CX-1 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80125-3-O | DU-145 (Prostate carcinoma) (cluster #3 of 9) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80132-2-O | EL4 (Thymoma cells) (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80139-1-O | G-401 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80164-3-O | HT-1080 (Fibrosarcoma cells) (cluster #3 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-3-O | HT-29 (Colon adenocarcinoma cells) (cluster #3 of 12) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80211-5-O | LoVo (Colon adenocarcinoma cells) (cluster #5 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80216-1-O | MAC13 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80229-1-O | MCF7-DOX (Breast carcinoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80231-2-O | MCF7S (Breast carcinoma cells) (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-3-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #3 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-7-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #7 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80284-3-O | MOLT-3 (T-lymphoblastic leukemia cells) (cluster #3 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80321-1-O | NCI-H345 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80354-3-O | OVCAR-3 (Ovarian adenocarcinoma cells) (cluster #3 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80415-1-O | Ramos (Burkitts lymhoma B-cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80420-1-O | RBL-2H3 (Basophilic leukemia cells) (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80434-1-O | RPTEC (Renal proximal tubule epithelial cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80437-1-O | RWLeu4 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80470-1-O | SGC-7901 (Gastric carcinoma cells) (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80479-1-O | SK-MEL (Melanoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80516-1-O | SUP-T1 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80578-1-O | UV4 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80596-1-O | WISH (Amniotic epithelial cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80601-1-O | XRS6 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80608-3-O | ZR-75-1 (Breast carcinoma cells) (cluster #3 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-4-O | T47D (Breast carcinoma cells) (cluster #4 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80752-1-O | carcinoma cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80773-1-O | CHRC/5 cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80838-1-O | EOL1 (Eosinophilic cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80866-1-O | GLC4 cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80889-1-O | NCI-H322M (Non-small cell lung carcinoma cells) (cluster #1 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80891-1-O | H4 (Hepatoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80901-2-O | HaCaT (Keratinocytes) (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80951-2-O | NIH3T3 (Fibroblasts) (cluster #2 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80954-3-O | HFF (Foreskin fibroblasts) (cluster #3 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80979-1-O | HOS cancer cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81011-3-O | human cell lines (cluster #3 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81017-5-O | WiDr (Colon adenocarcinoma cells) (cluster #5 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-2-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #2 of 8) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81030-1-O | Monocytes (Monocytic cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81037-1-O | Human ovarian carcinoma cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81043-1-O | N592 (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81045-1-O | Human squamous carcinoma cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81077-1-O | KATO III cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81130-1-O | KYSE-70 cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81146-1-O | LCLC-103H cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81164-1-O | LL cell line (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81170-5-O | LNCaP (Prostate carcinoma) (cluster #5 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81187-1-O | LT12 tumor cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81245-4-O | MDA-MB-435 (Breast carcinoma cells) (cluster #4 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-5-O | HeLa (Cervical adenocarcinoma cells) (cluster #5 of 9) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81261-1-O | UACC-375 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81331-6-O | SW-620 (Colon adenocarcinoma cells) (cluster #6 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81341-1-O | Tumor cell lines (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA7-2-E | Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #2 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1D-3-E | Alpha-1d adrenergic receptor (cluster #3 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AKT2-1-E | Serine/threonine-protein kinase AKT2 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AKT3-1-E | Serine/threonine-protein kinase AKT3 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ALDH2-1-E | Aldehyde dehydrogenase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ATP4A-2-E | Potassium-transporting ATPase alpha chain 1 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ATP4B-2-E | Potassium-transporting ATPase beta chain (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CA2D1-1-E | Voltage-gated calcium channel alpha2/delta subunit 1 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH1-2-E | Carbonic anhydrase I (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH2-2-E | Carbonic anhydrase II (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH9-1-E | Carbonic anhydrase IX (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CP19A-2-E | Cytochrome P450 19A1 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CXCR2-2-E | C-X-C chemokine receptor type 2 (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DHI1-1-E | 11-beta-hydroxysteroid dehydrogenase 1 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EAA3-1-E | Excitatory amino acid transporter 3 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FLT3-1-E | Tyrosine-protein kinase receptor FLT3 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GABR2-1-E | GABA-B receptor 2 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA2-2-E | GABA receptor alpha-2 subunit (cluster #2 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA3-2-E | GABA receptor alpha-3 subunit (cluster #2 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA4-2-E | GABA receptor alpha-4 subunit (cluster #2 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA4-3-E | GABA receptor alpha-4 subunit (cluster #3 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA5-1-E | GABA receptor alpha-5 subunit (cluster #1 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA6-1-E | GABA receptor alpha-6 subunit (cluster #1 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG1-2-E | GABA receptor gamma-1 subunit (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR1-3-E | GABA receptor rho-1 subunit (cluster #3 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR2-2-E | GABA receptor rho-2 subunit (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR3-1-E | GABA receptor rho-3 subunit (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLRA3-1-E | Glycine receptor subunit alpha-3 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GPR44-2-E | G protein-coupled receptor 44 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM5-4-E | Metabotropic glutamate receptor 5 (cluster #4 of 5) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| INSR-1-E | Insulin receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNA4-1-E | Voltage-gated potassium channel subunit Kv1.4 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX12-1-E | Arachidonate 12-lipoxygenase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| M3K9-1-E | Mitogen-activated protein kinase kinase kinase 9 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDR3-2-E | P-glycoprotein 3 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MK01-1-E | MAP kinase ERK2 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MK03-1-E | MAP kinase ERK1 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE1-2-E | Glutamate [NMDA] receptor subunit epsilon 1 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NTCP-1-E | Bile acid transporter (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| O3FA1-1-E | G-protein coupled receptor 120 (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRM-2-E | Mu opioid receptor (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OXER1-1-E | Oxoeicosanoid receptor 1 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PA24B-1-E | Phospholipase A2 group 1VB (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PA24C-1-E | Cytosolic phospholipase A2 gamma (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PA24D-1-E | Phospholipase A2 group 1VD (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PA2G6-1-E | Calcium-independent phospholipase A2 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PLD2-1-E | Phospholipase D2 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PLD3-1-E | Phospholipase D3 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPCE-1-E | Prolyl endopeptidase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q1R2J4-1-B | Type 1 fimbiral adhesin FimH (cluster #1 of 1) | Bacteria | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q864F1-1-E | Phosphodiesterase 5 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9I8A2-1-E | Adenosinetriphosphatase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN2A-2-E | Sodium channel protein type II alpha subunit (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBB-1-E | Tubulin beta chain (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| THIL-1-E | Acetyl-CoA acetyltransferase, mitochondrial (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TLR2-1-E | Toll-like receptor 2 (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TNFA-1-E | TNF-alpha (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV2-2-E | Transient receptor potential cation channel subfamily V member 2 (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV4-2-E | Transient receptor potential cation channel subfamily V member 4 (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| VP16-1-V | Alpha trans-inducing protein (VP16) (cluster #1 of 1) | Viruses | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100090-1-O | ABAE (Fibroblast cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100093-1-O | LX-1 (Lung carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100095-1-O | MIP (Colon carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100488-1-O | mast cells (Bone-marrow mast cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100494-1-O | C2C12 (Myoblast cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100497-2-O | Bovine viral diarrhea virus (cluster #2 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100498-2-O | Hepatocytes (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100501-1-O | Lu1 (Lung carcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100502-1-O | ARO (Anaplastic thyroid carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100516-1-O | Hs 683 (Glioma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100690-1-O | Panc1005 (Pancreatic carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100691-1-O | Panc203 (Pancreatic carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100699-1-O | Chromobacterium violaceum (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100710-1-O | Cynomolgus monkey (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100711-1-O | Baboon (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100715-2-O | Nippostrongylus brasiliensis (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100752-1-O | Renca (Renal carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100755-1-O | SUD4 (B-cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100756-1-O | SVR (Endothelial cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100759-1-O | T-lymphocytes (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101672-1-O | Balanus improvisus (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101767-1-O | Dengue virus 2 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101870-1-O | Leishmania guyanensis (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101879-1-O | Leptomonas seymouri (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102080-1-O | Simplexvirus (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102121-3-O | Trichophyton mentagrophytes (cluster #3 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102131-1-O | Vaccinia virus Copenhagen (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102233-1-O | Artery (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102279-1-O | Kidney (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102306-2-O | Aorta (cluster #2 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102306-6-O | Aorta (cluster #6 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102317-1-O | Brain (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103192-1-O | Trypanosoma evansi (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103324-1-O | MSTO-211H (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103356-1-O | NCI-H28 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103413-1-O | SW948 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104300-1-O | Mitogen-activated protein kinase; ERK1/ERK2 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50028-1-O | Streptococcus pneumoniae (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50038-2-O | Plasmodium yoelii yoelii (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50117-1-O | Pseudomonas aeruginosa (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50142-1-O | Influenza A virus (A/PR/8/34(H1N1)) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50186-1-O | Staphylococcus epidermidis (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50278-1-O | Bacillus subtilis (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50347-3-O | Saccharomyces cerevisiae (cluster #3 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-5-O | Trypanosoma brucei brucei (cluster #5 of 7) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50422-2-O | Entamoeba histolytica (cluster #2 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50424-2-O | Cryptosporidium parvum (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-19-O | Plasmodium falciparum (cluster #19 of 22) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-8-O | Plasmodium falciparum (cluster #8 of 22) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50446-1-O | Candida tropicalis (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50458-2-O | Leishmania braziliensis (cluster #2 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50458-3-O | Leishmania braziliensis (cluster #3 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50467-1-O | Trichomonas vaginalis (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50467-2-O | Trichomonas vaginalis (cluster #2 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50518-2-O | Human herpesvirus 4 (cluster #2 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-4-O | Oryctolagus cuniculus (cluster #4 of 8) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-3-O | Mus musculus (cluster #3 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50609-2-O | Simian immunodeficiency virus (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50612-1-O | Moloney murine sarcoma virus (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50614-1-O | Human T-lymphotropic virus 1 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50622-1-O | Human rhinovirus 1B (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50624-1-O | Human adenovirus type 2 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50643-4-O | Hepatitis C virus (cluster #4 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50652-3-O | Influenza A virus (cluster #3 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50676-2-O | Dengue virus (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50746-2-O | Human enterovirus 71 (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50796-1-O | Monkey (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80008-2-O | 5637 (Epithelial bladder carcinoma cells) (cluster #2 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80017-2-O | A2780cisR (Cisplatin-resistant ovarian carcinoma cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80019-2-O | A-427 (Lung carcinoma cells) (cluster #2 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80024-2-O | A9 (Fibroblast cells) (cluster #2 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80025-3-O | ACHN (Renal adenocarcinoma cells) (cluster #3 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80030-2-O | ANN-1 (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80039-1-O | BGC-823 (Stomach adenocarcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80039-2-O | BGC-823 (Stomach adenocarcinoma cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80067-1-O | CCRF-HSB-2 (T-cell leukemia cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80068-3-O | CCRF-SB (Lymphoblastic leukemia cells) (cluster #3 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80076-2-O | CEM-SS (T-cell leukemia) (cluster #2 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80084-1-O | CEM-VLB (Vinblastine-resistant T-cell leukemia cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80085-1-O | CEM-VM1 (Etoposide-resistant T-cell leukemia cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80088-2-O | CHO (Ovarian cells) (cluster #2 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80091-1-O | CHO-hD3 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80092-1-O | CHO-K1 (Ovarian cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80105-1-O | COR-L23 (Lung carcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80115-1-O | DC3F (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80117-2-O | DC3F/AD-II (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80120-2-O | DLD-1 (Colon adenocarcinoma cells) (cluster #2 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80121-1-O | DMS-79 (Small cell lung carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80125-9-O | DU-145 (Prostate carcinoma) (cluster #9 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80136-2-O | FM3A (Breast carcinoma cells) (cluster #2 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80143-2-O | H322 (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80145-1-O | H69 (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80150-2-O | H9c2 (Cardiomyoblast cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-11-O | HL-60 (Promyeloblast leukemia cells) (cluster #11 of 12) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-6-O | HL-60 (Promyeloblast leukemia cells) (cluster #6 of 12) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-8-O | HT-29 (Colon adenocarcinoma cells) (cluster #8 of 12) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-9-O | HT-29 (Colon adenocarcinoma cells) (cluster #9 of 12) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80178-2-O | J774.A1 (Macrophage cells) (cluster #2 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80179-1-O | J82 (Bladder carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-5-O | L1210 (Lymphocytic leukemia cells) (cluster #5 of 12) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80214-2-O | M14 (Melanoma cells) (cluster #2 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80218-1-O | MAC16 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-5-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #5 of 7) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80250-1-O | Me665/2/21 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80255-1-O | MES-SA/DxS (Uterine sarcoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80285-3-O | MOLT-4 (Acute T-lymphoblastic leukemia cells) (cluster #3 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80298-1-O | N1E-115 (Neuroblastoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80342-1-O | NSCLC (Non-small cell lung carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-5-O | PC-3 (Prostate carcinoma cells) (cluster #5 of 10) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80421-1-O | RD (Rhabdomyosarcoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80435-1-O | RT-112 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80436-1-O | RT-4 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80449-1-O | SAOS-2 (Osteosarcoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80455-1-O | SCC-15 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80466-4-O | SF268 (cluster #4 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80472-1-O | SiHa (Cervical squamous cell carcinoma) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80485-5-O | SK-MEL-28 (Melanoma cells) (cluster #5 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80490-3-O | SK-MES-1 (cluster #3 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80493-6-O | SK-OV-3 (Ovarian carcinoma cells) (cluster #6 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80494-1-O | SKUT-1A (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80503-1-O | SNU1 (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80532-6-O | T-24 (Bladder carcinoma cells) (cluster #6 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80545-3-O | TE-671 (cluster #3 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80546-1-O | TERT-RPE1 (Retinal pigmented epithelial cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80551-1-O | TK-10 (Renal carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80573-1-O | UMSCC22B (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80583-4-O | Vero (Kidney cells) (cluster #4 of 7) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80585-1-O | WALKER (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80595-1-O | WIL2-NS (Lymphoblastoid cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80600-2-O | XF498 (Glioma cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80606-1-O | YOSHIDA (Sarcoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80608-2-O | ZR-75-1 (Breast carcinoma cells) (cluster #2 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80608-4-O | ZR-75-1 (Breast carcinoma cells) (cluster #4 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80612-1-O | 2008 (Ovarian carcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80623-1-O | Panel (56 tumour cell lines) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80653-2-O | 9L (Glioma cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80667-1-O | AA8 (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80695-1-O | BE (Colon adenocarcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80697-3-O | Bel-7402 (Hepatoma cells) (cluster #3 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80699-1-O | BE-NQ (Colon adenocarcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80704-1-O | BJ (Foreskin fibroblast cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80735-1-O | C38 (Colon carcinoma) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80762-1-O | BP8 (Ascites sarcoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80792-2-O | Colon 26 (Colon adenocarcinoma cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80846-1-O | F460pv8/eto cell line (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80847-2-O | FaDu (Pharyngeal carcinoma cells) (cluster #2 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80847-3-O | FaDu (Pharyngeal carcinoma cells) (cluster #3 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80851-1-O | Fibroblast MRHFcell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80885-1-O | bEND (Brain endothelial cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80887-1-O | H2981 cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80898-1-O | NCI-H928 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80930-1-O | HEC-1B cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80943-1-O | HEL 299 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80972-1-O | HOP-92 (Non-small cell lung carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81008-1-O | Human breast cancer cell lines (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-10-O | A2780 (Ovarian carcinoma cells) (cluster #10 of 10) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-9-O | A2780 (Ovarian carcinoma cells) (cluster #9 of 10) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-10-O | Jurkat (Acute leukemic T-cells) (cluster #10 of 10) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81084-1-O | KB VCR R (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81126-1-O | KYSE-150 cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81128-1-O | KYSE-520 cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81134-1-O | L2987 (Lung adenocarcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81138-3-O | ScN2a (Scrapie-infected neuroblastoma cells) (cluster #3 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81159-1-O | Lewis cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81164-2-O | LL cell line (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81166-1-O | LLC cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81169-1-O | LMM3 cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81235-1-O | M4Beu cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-9-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #9 of 11) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81255-1-O | MDR (Multi-drug resistant cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81277-1-O | NCI-N417 (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81280-3-O | NCI-H226 (Non-small cell lung carcinoma cells) (cluster #3 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81281-2-O | NCI-H23 (Non-small cell lung carcinoma cells) (cluster #2 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81284-1-O | NCI-H647 (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81321-1-O | SNB- (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81331-5-O | SW-620 (Colon adenocarcinoma cells) (cluster #5 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ZAP70-1-E | Tyrosine-protein kinase ZAP-70 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2B-3-E | Alpha-2b adrenergic receptor (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AHR-2-E | Aryl hydrocarbon receptor (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AOFA-2-E | Monoamine oxidase A (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AURKB-1-E | Serine/threonine-protein kinase Aurora-B (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| B7X946-1-E | Melatonin receptor 1B (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BLO1-1-B | Beta-lactamase OXA-1 (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CADH2-1-E | Cadherin-2 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH4-2-E | Carbonic anhydrase IV (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH9-2-E | Carbonic anhydrase IX (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CARP-1-F | Rhizopuspepsin (cluster #1 of 1) | Fungi | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CASP3-1-E | Caspase-3 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CATL1-1-E | Cathepsin L (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CATS-1-E | Cathepsin S (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CNR2-2-E | Cannabinoid CB2 receptor (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CP17A-1-E | Cytochrome P450 17A1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| D3ZWV0-1-E | Retinoic acid receptor gamma (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DYR-1-E | Dihydrofolate reductase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| E2R517-1-E | Uncharacterized protein (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EAA2-1-E | Excitatory amino acid transporter 2 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ELNE-1-E | Leukocyte elastase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ENV-1-V | Envelope glycoprotein gp160 (cluster #1 of 1) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERG1-2-E | Squalene monooxygenase (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERG7-2-E | Lanosterol synthase (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERR2-1-E | Estrogen-related receptor beta (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FDFT-1-E | Squalene synthetase (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FDFT-2-E | Squalene synthetase (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FNTA-2-E | Protein farnesyltransferase/geranylgeranyltransferase type I alpha subunit (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FNTB-2-E | Protein farnesyltransferase beta subunit (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA1-5-E | GABA receptor alpha-1 subunit (cluster #5 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA2-3-E | GABA receptor alpha-2 subunit (cluster #3 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA2-4-E | GABA receptor alpha-2 subunit (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA3-3-E | GABA receptor alpha-3 subunit (cluster #3 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA3-4-E | GABA receptor alpha-3 subunit (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA4-4-E | GABA receptor alpha-4 subunit (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA5-2-E | GABA receptor alpha-5 subunit (cluster #2 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA5-4-E | GABA receptor alpha-5 subunit (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA6-2-E | GABA receptor alpha-6 subunit (cluster #2 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA6-4-E | GABA receptor alpha-6 subunit (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB3-2-E | GABA receptor beta-3 subunit (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRE-1-E | GABA receptor epsilon subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG3-1-E | GABA receptor gamma-3 subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRP-1-E | GABA receptor pi subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR1-2-E | GABA receptor rho-1 subunit (cluster #2 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR2-1-E | GABA receptor rho-2 subunit (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR2-3-E | GABA receptor rho-2 subunit (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRT-1-E | GABA receptor theta subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GCYA1-1-E | Guanylate cyclase soluble alpha-1 chain (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GCYB1-1-E | Guanylate cyclase soluble beta-1 chain (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM1-5-E | Metabotropic glutamate receptor 1 (cluster #5 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRPR-1-E | Gastrin releasing peptide receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC1-2-E | Histone deacetylase 1 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC2-2-E | Histone deacetylase 2 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC3-2-E | Histone deacetylase 3 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC4-2-E | Histone deacetylase 4 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC5-2-E | Histone deacetylase 5 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC7-2-E | Histone deacetylase 7 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC8-2-E | Histone deacetylase 8 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC9-2-E | Histone deacetylase 9 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IKKE-1-E | Inhibitor of nuclear factor kappa B kinase epsilon subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IL2RA-1-E | Interleukin-2 receptor alpha chain (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITA2-1-E | Integrin alpha-2 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| JAK3-1-E | Tyrosine-protein kinase JAK3 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNE1-1-E | Voltage-gated potassium channel beta subunit Mink (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNQ3-1-E | Voltage-gated potassium channel subunit Kv7.3 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNQ5-1-E | Voltage-gated potassium channel subunit Kv7.5 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR1-4-E | Lysophosphatidic acid receptor Edg-2 (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR5-1-E | Lysophosphatidic acid receptor 5 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LPAR5-2-E | Lysophosphatidic acid receptor 5 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LYN-1-E | Tyrosine-protein kinase Lyn (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| M3K1-1-E | Mitogen-activated protein kinase kinase kinase 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MMP13-1-E | Matrix metalloproteinase 13 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MMP7-1-E | Matrix metalloproteinase 7 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MPRI-1-E | Insulin-like growth factor II receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOS1-1-E | Nitric-oxide synthase, brain (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOS2-3-E | Nitric oxide synthase, inducible (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NR1H2-2-E | LXR-beta (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NR4A1-1-E | Nuclear receptor subfamily 4 group A member 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NR5A2-1-E | Orphan nuclear receptor LRH-1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| O3FA1-2-E | G-protein coupled receptor 120 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2Y12-2-E | Purinergic receptor P2Y12 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE2A-1-E | Phosphodiesterase 2A (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PERM-1-E | Myeloperoxidase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARD-2-E | Peroxisome proliferator-activated receptor delta (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PTH1R-1-E | Parathyroid hormone receptor (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PTH1R-2-E | Parathyroid hormone receptor (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q6L5J4-1-E | FML2_HUMAN (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q77YF8-1-V | Human immunodeficiency virus type 1 REV (cluster #1 of 1) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q7TNH1-1-E | Peroxisome proliferator activated receptor alpha (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q8VH26-1-E | Muscarinic acetylcholine receptor M3 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q94F81-1-E | Histone deacetylase HD2 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| QRFPR-1-E | Pyroglutamylated RFamide peptide receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RAF1-1-E | Serine/threonine-protein kinase RAF (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SAHH-1-E | Adenosylhomocysteinase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SHBG-1-E | Testis-specific androgen-binding protein (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SL9A5-1-E | Sodium/hydrogen exchanger 5 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SSR1-1-E | Somatostatin receptor 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SSR4-1-E | Somatostatin receptor 4 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ST14-1-E | Matriptase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SYLC-1-E | Leucyl-tRNA synthetase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TAT-2-V | Human immunodeficiency virus type 1 Tat protein (cluster #2 of 2) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TBA1A-2-E | Tubulin alpha-1 chain (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPA1-6-E | Transient receptor potential cation channel subfamily A member 1 (cluster #6 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV1-4-E | Vanilloid receptor (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV2-3-E | Transient receptor potential cation channel subfamily V member 2 (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TRPV4-3-E | Transient receptor potential cation channel subfamily V member 4 (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TSHR-1-E | Thyroid stimulating hormone receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100089-1-O | F5.12 (IL3-dependent haematopoietic cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100256-1-O | Proteasome (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100337-1-O | W1-L2 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100498-1-O | Hepatocytes (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100500-1-O | 4T1 (Mammary carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100519-1-O | KETR3 (Renal carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100521-1-O | L1.2 (Pre-B cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100697-1-O | Xanthomonas campestris (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100704-1-O | Lactuca sativa (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100715-1-O | Nippostrongylus brasiliensis (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100731-1-O | Bcap37 (Breast carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100745-1-O | MX1 (Breast carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100745-2-O | MX1 (Breast carcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100747-1-O | Neurons (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100748-2-O | Neutrophils (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100751-2-O | PMNL (Polymorphonuclear leukocytes) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100753-1-O | SHP77 (Small cell lung carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100768-1-O | TPC1 (Papillary thyroid carinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100816-1-O | SCG (Superior cervical ganglion neurones) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101645-1-O | Amaranthus hypochondriacus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101666-1-O | Bacillus anthracis (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101697-1-O | Camelpox virus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101736-1-O | Colletotrichum coccodes (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101775-1-O | Drosophila (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101821-2-O | H2N2 subtype (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101829-1-O | HBV genotype D (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101845-1-O | Human echovirus 13 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101846-2-O | Human echovirus 6 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101848-1-O | Human herpesvirus 8 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101870-2-O | Leishmania guyanensis (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101892-1-O | Magnaporthe oryzae (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101896-1-O | Mammalian orthoreovirus 1 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101909-1-O | Microcystis aeruginosa (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102098-1-O | Staphylococcus lentus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102121-1-O | Trichophyton mentagrophytes (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102138-1-O | Vibrio harveyi (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102258-1-O | Trachea (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102275-1-O | Hypothalamus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102280-1-O | Liver (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102289-1-O | Plasma (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102315-1-O | Blood (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102331-1-O | Hippocampus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102333-1-O | Ileum (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102372-1-O | Aorta (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102380-3-O | Ileum (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102476-1-O | Acanthamoeba castellanii (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102478-1-O | Acanthamoeba polyphaga (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102516-1-O | Human rhinovirus strain Hanks (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103176-2-O | Entamoeba invadens (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103181-1-O | Microdochium nivale (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103192-2-O | Trypanosoma evansi (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103200-1-O | 769-P (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103202-1-O | 8505C (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103202-2-O | 8505C (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103204-4-O | A427 (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103205-4-O | A431 (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103219-1-O | Ca9-22 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103274-1-O | HCC1954 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103343-1-O | NCI-H2009 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103348-1-O | NCI-H2122 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103348-2-O | NCI-H2122 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103359-1-O | NCI-H661 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103393-1-O | SK-N-AS (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103407-2-O | SW1990 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103408-1-O | SW626 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103410-1-O | SW780 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103419-1-O | UACC-812 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103420-1-O | UACC-893 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103461-1-O | Dermabacter hominis (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104287-1-O | Neuronal acetylcholine receptor; alpha3/beta4 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50028-2-O | Streptococcus pneumoniae (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50046-2-O | Trichophyton quinckeanum (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50076-1-O | Poliovirus (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50132-1-O | Human rhinovirus 39 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50136-3-O | Plasmodium falciparum (isolate FcB1 / Columbia) (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50212-4-O | Escherichia coli (cluster #4 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50274-1-O | Aspergillus flavus (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50274-2-O | Aspergillus flavus (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50275-1-O | Aspergillus niger (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50275-2-O | Aspergillus niger (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50324-2-O | Arabidopsis thaliana (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50335-1-O | Oryza sativa (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50347-1-O | Saccharomyces cerevisiae (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50347-2-O | Saccharomyces cerevisiae (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50375-1-O | Propionibacterium acnes (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50380-3-O | Mycobacterium smegmatis (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50409-2-O | Kluyveromyces marxianus (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50416-2-O | Aspergillus fumigatus (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50418-4-O | Trypanosoma brucei (cluster #4 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-21-O | Plasmodium falciparum (cluster #21 of 22) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-22-O | Plasmodium falciparum (cluster #22 of 22) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50442-3-O | Candida albicans (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50444-2-O | Candida parapsilosis (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50452-2-O | Trichophyton rubrum (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50457-2-O | Leishmania amazonensis (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50458-4-O | Leishmania braziliensis (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-6-O | Leishmania donovani (cluster #6 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-7-O | Leishmania donovani (cluster #7 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50461-2-O | Leishmania mexicana (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50468-1-O | Giardia intestinalis (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50468-3-O | Giardia intestinalis (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50472-4-O | Toxoplasma gondii (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50473-1-O | Plasmodium berghei (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50476-1-O | Tetrahymena pyriformis (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50501-3-O | Gallus gallus (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50502-1-O | Meleagris gallopavo (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50507-1-O | Equus caballus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50518-1-O | Human herpesvirus 4 (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50518-4-O | Human herpesvirus 4 (cluster #4 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50525-1-O | Tacaribe virus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50529-2-O | Cytomegalovirus (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50530-5-O | Human herpesvirus 5 (cluster #5 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50531-1-O | Caenorhabditis elegans (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50574-2-O | Xenopus sp. (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50588-7-O | Canis familiaris (cluster #7 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-7-O | Human immunodeficiency virus 1 (cluster #7 of 10) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50611-3-O | Moloney murine leukemia virus (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50612-2-O | Moloney murine sarcoma virus (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50615-2-O | Human echovirus 9 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50618-2-O | Human coxsackievirus B5 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50619-1-O | Human poliovirus 1 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50636-1-O | Sindbis virus (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50636-3-O | Sindbis virus (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50642-1-O | Yellow fever virus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50643-3-O | Hepatitis C virus (cluster #3 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50652-4-O | Influenza A virus (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50664-1-O | Rauscher murine leukemia virus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50667-2-O | Human coxsackievirus B1 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50676-1-O | Dengue virus (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50677-3-O | Human immunodeficiency virus (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50678-1-O | Respiratory syncytial virus (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50681-1-O | Duck hepatitis B virus (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50692-1-O | Human rhinovirus 16 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50746-1-O | Human enterovirus 71 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50755-1-O | Anas sp. (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80001-2-O | 143B (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80002-2-O | 1A9 (Ovarian adenocarcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80008-3-O | 5637 (Epithelial bladder carcinoma cells) (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80013-1-O | A10 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80013-2-O | A10 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80015-1-O | A2058 (Melanoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80017-1-O | A2780cisR (Cisplatin-resistant ovarian carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80019-3-O | A-427 (Lung carcinoma cells) (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80026-2-O | AGS (Gastric adenocarcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80030-1-O | ANN-1 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80035-4-O | B16 (Melanoma cells) (cluster #4 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80035-6-O | B16 (Melanoma cells) (cluster #6 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80035-7-O | B16 (Melanoma cells) (cluster #7 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80036-3-O | BaF3 (IL-3-dependent pro-B-cells) (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80051-1-O | C6-BU-1 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80054-2-O | Caco-2 (Colon adenocarcinoma cells) (cluster #2 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80055-2-O | CAKI-1 (Kidney carcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80057-1-O | Calu-1 (Non-small cell lung carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80058-1-O | Calu-3 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80060-1-O | CAPAN-1 (Pancreatic adenocarcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-3-O | CCRF-CEM (T-cell leukemia) (cluster #3 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-4-O | CCRF-CEM (T-cell leukemia) (cluster #4 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-9-O | CCRF-CEM (T-cell leukemia) (cluster #9 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80079-1-O | CEM-V (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80083-1-O | CEM-VCR 1000 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80088-4-O | CHO (Ovarian cells) (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80096-1-O | CHO-TAX 5-6 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80097-1-O | CHO-VV 3-2 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80100-1-O | COLO 320 (Colon adenocarcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80101-1-O | COLO 320DM (Colon adenocarcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80105-2-O | COR-L23 (Lung carcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80109-2-O | CTLL (Cytotoxic T-cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80112-2-O | DAN-G (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80113-1-O | Daoy (Medulloblastoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80113-2-O | Daoy (Medulloblastoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80114-1-O | Daudi (Burkitts lymphoma cells) (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80118-1-O | Detroit 551 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80120-5-O | DLD-1 (Colon adenocarcinoma cells) (cluster #5 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80123-1-O | DO4 (Melanoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80125-5-O | DU-145 (Prostate carcinoma) (cluster #5 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80125-6-O | DU-145 (Prostate carcinoma) (cluster #6 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80126-1-O | DuPro (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80126-2-O | DuPro (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80130-1-O | EJ (Bladder carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80134-1-O | EVSA-T (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80136-3-O | FM3A (Breast carcinoma cells) (cluster #3 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80141-1-O | GH3 (Pituitary adenoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-8-O | HL-60 (Promyeloblast leukemia cells) (cluster #8 of 12) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-11-O | K562 (Erythroleukemia cells) (cluster #11 of 11) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-7-O | K562 (Erythroleukemia cells) (cluster #7 of 11) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80188-2-O | KB 3-1 (Cervical epithelial carcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80192-2-O | KM12 (Colon adenocarcinoma cells) (cluster #2 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-8-O | L1210 (Lymphocytic leukemia cells) (cluster #8 of 12) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-13-O | MCF7 (Breast carcinoma cells) (cluster #13 of 14) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-14-O | MCF7 (Breast carcinoma cells) (cluster #14 of 14) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80227-2-O | MCF7-ADR (Breast carcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80232-1-O | MCF7-VP (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-6-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #6 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80249-2-O | MDCK (Kidney cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80268-1-O | MKN-28 (Gastric epithelial carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80280-1-O | MNNG-HOS (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80282-1-O | MO/Mphi (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80288-1-O | MOVP-3 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-3-O | MT4 (Lymphocytes) (cluster #3 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-4-O | MT4 (Lymphocytes) (cluster #4 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80301-1-O | N9 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80301-2-O | N9 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80310-1-O | NCH82 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80335-2-O | NHDF (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80346-1-O | NUGC (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80353-1-O | OVCAR (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80359-1-O | P19 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-5-O | P388 (Lymphoma cells) (cluster #5 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80369-1-O | P388/VCR-20 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80377-2-O | PaCa2 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80387-2-O | PC-12 (Adrenal phaeochromacytoma cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-6-O | PC-3 (Prostate carcinoma cells) (cluster #6 of 10) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80412-1-O | R3230AC (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80418-8-O | RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #8 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80429-1-O | RPMI 6410 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80433-2-O | RPMI-8226 (Multiple myeloma cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80453-2-O | SC-3 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80461-1-O | SCL-1 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80463-1-O | SCOV-3 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80473-2-O | SISO (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80481-1-O | SK-MEL-1 (Metastatic melanoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80482-4-O | SK-MEL-2 (Melanoma cells) (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80485-2-O | SK-MEL-28 (Melanoma cells) (cluster #2 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80485-4-O | SK-MEL-28 (Melanoma cells) (cluster #4 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80490-1-O | SK-MES-1 (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80490-4-O | SK-MES-1 (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80491-4-O | SK-N-MC (Neuroepithelioma cells) (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80498-1-O | SN12C (Renal carcinoma cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80500-1-O | SNB-7 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80503-2-O | SNU1 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80514-1-O | St-4 (Stomach carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80526-3-O | SW480 (Colon adenocarcinoma cells) (cluster #3 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80526-4-O | SW480 (Colon adenocarcinoma cells) (cluster #4 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80532-5-O | T-24 (Bladder carcinoma cells) (cluster #5 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80552-1-O | TLX-5 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80559-2-O | U251 (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80565-2-O | U-87 MG (Glioblastoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80570-1-O | UACC-62 (Melanoma cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80571-1-O | UCLA P-3 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80574-2-O | UMUC3 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80581-1-O | VA13 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80583-3-O | Vero (Kidney cells) (cluster #3 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80583-5-O | Vero (Kidney cells) (cluster #5 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80583-6-O | Vero (Kidney cells) (cluster #6 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80589-2-O | WI-38 (Embryonic lung fibroblast cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80593-1-O | WiDr-NTR (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80604-2-O | YAPC (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80641-1-O | 791T cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80647-1-O | 833K cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80653-1-O | 9L (Glioma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80662-1-O | AA5 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-5-O | A549 (Lung carcinoma cells) (cluster #5 of 11) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80683-1-O | ATH8 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80688-1-O | B(EBV+) cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80695-2-O | BE (Colon adenocarcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80697-2-O | Bel-7402 (Hepatoma cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80709-1-O | Osteoclast-like (Bone marrow cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-5-O | T47D (Breast carcinoma cells) (cluster #5 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-7-O | T47D (Breast carcinoma cells) (cluster #7 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80721-1-O | BxT cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80724-1-O | C170 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80726-1-O | TRAMP-C1A (Prostate carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80730-1-O | C2D cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80731-1-O | C2G cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80732-1-O | TRAMP-C2H (Prostate carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80742-2-O | C6 (Glioma cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80742-3-O | C6 (Glioma cells) (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80760-1-O | CFU-GM cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80761-1-O | AhR+/+5L (Hepatoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80774-1-O | CHRC5 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80800-2-O | MIA PaCa-2 (Pancreatic carcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80801-2-O | CRL-7065 cell line (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80807-1-O | D283 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80816-1-O | DA-3 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80846-2-O | F460pv8/eto cell line (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80857-2-O | Friend leukemia cell line (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80865-1-O | GHOST CXCR4 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80870-2-O | GM892A cell line (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80871-1-O | Granta cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80874-5-O | CEM (T-cell leukemia) (cluster #5 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80876-1-O | NCI-H125 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80878-2-O | NCI-H157 (Non-small cell lung carcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80889-2-O | NCI-H322M (Non-small cell lung carcinoma cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-7-O | HCT-116 (Colon carcinoma cells) (cluster #7 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-8-O | HCT-116 (Colon carcinoma cells) (cluster #8 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80945-3-O | HEp-2 (Laryngeal carcinoma cells) (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80949-1-O | Hepatoma cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80963-1-O | HNO 97 cell lines (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80966-1-O | HONE1 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80967-1-O | Hone-1 cell line (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80980-1-O | HOS (Osteosarcoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80980-2-O | HOS (Osteosarcoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80991-2-O | Hs-578T (Breast carcinoma cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81000-1-O | HT-22 (Hippocampal cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81005-1-O | HTB-54 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-6-O | HepG2 (Hepatoblastoma cells) (cluster #6 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-6-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #6 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-5-O | A2780 (Ovarian carcinoma cells) (cluster #5 of 10) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81041-1-O | Prostatic carcinoma cells (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81043-2-O | N592 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81047-2-O | Human T-cell line (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81051-2-O | Human Tumor Cell lines (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81055-1-O | HuT78 (T-lymphoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81070-1-O | JAM cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81101-1-O | KBM-3 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81102-1-O | KBM-3/DOX cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81115-6-O | KB (Squamous cell carcinoma) (cluster #6 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81117-2-O | Keratinocytes (Keratinocytes) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81137-2-O | L929 (Fibroblast cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81138-2-O | ScN2a (Scrapie-infected neuroblastoma cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81165-1-O | LL2 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81184-4-O | LOX IMVI (Melanoma cells) (cluster #4 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81184-5-O | LOX IMVI (Melanoma cells) (cluster #5 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81190-1-O | NCI-H520 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81192-1-O | PC-8 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81193-1-O | PC-9 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81201-1-O | HOP-62 (Non-small cell lung carcinoma cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81211-1-O | LXFL529 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81217-1-O | LY3.7.2C TK-/- cell lines (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81223-1-O | M cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81227-1-O | M-19 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81233-2-O | M21 (Melanoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81240-1-O | MAC15A (Colon adenocarcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81246-1-O | MDA-N (Breast carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-8-O | HeLa (Cervical adenocarcinoma cells) (cluster #8 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81257-1-O | MEL-AC cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81264-2-O | V79 (Lung fibroblasts) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81267-1-O | Mononuclear cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81277-2-O | NCI-N417 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81279-1-O | NCI (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81281-4-O | NCI-H23 (Non-small cell lung carcinoma cells) (cluster #4 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81281-5-O | NCI-H23 (Non-small cell lung carcinoma cells) (cluster #5 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81283-2-O | NCI-H522 (Non-small cell lung carcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81284-2-O | NCI-H647 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81286-1-O | NIH-K cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81289-1-O | DOV13 (Ovarian carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81298-1-O | PE cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81331-3-O | SW-620 (Colon adenocarcinoma cells) (cluster #3 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81338-3-O | T-cells (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81342-1-O | tumour cell lines (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |