Binding 10μM Binding 1μM Functional 10μM ADME/T 10μM
| Name (Code) | Description | Organism Class | Size | Browse | Download (Annotations) |
|---|---|---|---|---|---|
| Z50425-3-O | Plasmodium falciparum (cluster #3 of 22) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-2-O | L1210 (Lymphocytic leukemia cells) (cluster #2 of 12) | Other | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-1-O | MCF7 (Breast carcinoma cells) (cluster #1 of 14) | Other | 13 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50212-1-O | Escherichia coli (cluster #1 of 7) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-1-O | HT-29 (Colon adenocarcinoma cells) (cluster #1 of 12) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-1-O | A549 (Lung carcinoma cells) (cluster #1 of 11) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81115-2-O | KB (Squamous cell carcinoma) (cluster #2 of 6) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-2-O | HL-60 (Promyeloblast leukemia cells) (cluster #2 of 12) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-1-O | HeLa (Cervical adenocarcinoma cells) (cluster #1 of 9) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-1-O | K562 (Erythroleukemia cells) (cluster #1 of 11) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-1-O | P388 (Lymphoma cells) (cluster #1 of 8) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARG-2-E | Peroxisome proliferator-activated receptor gamma (cluster #2 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80035-1-O | B16 (Melanoma cells) (cluster #1 of 7) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80188-1-O | KB 3-1 (Cervical epithelial carcinoma cells) (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50380-2-O | Mycobacterium smegmatis (cluster #2 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-1-O | PC-3 (Prostate carcinoma cells) (cluster #1 of 10) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80475-1-O | SK-BR-3 (Breast adenocarcinoma) (cluster #1 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-1-O | HCT-116 (Colon carcinoma cells) (cluster #1 of 9) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-1-O | Jurkat (Acute leukemic T-cells) (cluster #1 of 10) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50530-1-O | Human herpesvirus 5 (cluster #1 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50590-1-O | Sus scrofa (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-12-O | Rattus norvegicus (cluster #12 of 12) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-7-O | Rattus norvegicus (cluster #7 of 12) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80025-1-O | ACHN (Renal adenocarcinoma cells) (cluster #1 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80125-1-O | DU-145 (Prostate carcinoma) (cluster #1 of 9) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-1-O | HL-60 (Promyeloblast leukemia cells) (cluster #1 of 12) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80364-1-O | P388/ADR (Lymphoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80485-1-O | SK-MEL-28 (Melanoma cells) (cluster #1 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80493-2-O | SK-OV-3 (Ovarian carcinoma cells) (cluster #2 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80583-1-O | Vero (Kidney cells) (cluster #1 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-2-O | T47D (Breast carcinoma cells) (cluster #2 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80768-1-O | CH1 (Ovarian carcinoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80936-1-O | HEK293 (Embryonic kidney fibroblasts) (cluster #1 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80945-1-O | HEp-2 (Laryngeal carcinoma cells) (cluster #1 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80954-1-O | HFF (Foreskin fibroblasts) (cluster #1 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81017-1-O | WiDr (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-1-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #1 of 8) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-2-O | A2780 (Ovarian carcinoma cells) (cluster #2 of 10) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81245-1-O | MDA-MB-435 (Breast carcinoma cells) (cluster #1 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-3-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #3 of 11) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-4-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #4 of 11) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81331-1-O | SW-620 (Colon adenocarcinoma cells) (cluster #1 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81335-1-O | HCT-15 (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EGFR-2-E | Epidermal growth factor receptor erbB1 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA1-3-E | Glutamate receptor ionotropic, AMPA 1 (cluster #3 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA2-3-E | Glutamate receptor ionotropic, AMPA 2 (cluster #3 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA3-2-E | Glutamate receptor ionotropic, AMPA 3 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM1-4-E | Metabotropic glutamate receptor 1 (cluster #4 of 5) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM8-1-E | Metabotropic glutamate receptor 8 (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARG-1-E | Peroxisome proliferator-activated receptor gamma (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100081-2-O | PBMC (Peripheral blood mononuclear cells) (cluster #2 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103196-1-O | 22RV1 (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50038-1-O | Plasmodium yoelii yoelii (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50136-2-O | Plasmodium falciparum (isolate FcB1 / Columbia) (cluster #2 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50212-6-O | Escherichia coli (cluster #6 of 7) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50339-1-O | Pneumocystis carinii (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-1-O | Trypanosoma brucei brucei (cluster #1 of 7) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-5-O | Plasmodium falciparum (cluster #5 of 22) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-2-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #2 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50473-4-O | Plasmodium berghei (cluster #4 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-6-O | Cavia porcellus (cluster #6 of 7) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-4-O | Homo sapiens (cluster #4 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-5-O | Homo sapiens (cluster #5 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-1-O | Mus musculus (cluster #1 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-3-O | Human immunodeficiency virus 1 (cluster #3 of 10) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50725-6-O | Trypanosoma brucei rhodesiense (cluster #6 of 7) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80002-2-O | 1A9 (Ovarian adenocarcinoma cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80003-1-O | 1A9/ptx-10 (Ovarian adenocarcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80004-1-O | 1A9/ptx-22 (Ovarian adenocarcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80017-1-O | A2780cisR (Cisplatin-resistant ovarian carcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80021-3-O | A498 (Renal carcinoma cells) (cluster #3 of 5) | 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 |
| Z80064-1-O | CCRF-CEM (T-cell leukemia) (cluster #1 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80088-1-O | CHO (Ovarian cells) (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80114-1-O | Daudi (Burkitts lymphoma cells) (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-10-O | HT-29 (Colon adenocarcinoma cells) (cluster #10 of 12) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-4-O | K562 (Erythroleukemia cells) (cluster #4 of 11) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80211-1-O | LoVo (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80227-1-O | MCF7-ADR (Breast carcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80240-1-O | MDA-MB-361 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80254-1-O | MES-SA (Uterine sarcoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80255-2-O | MES-SA/DxS (Uterine sarcoma cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80264-1-O | MH60 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80269-1-O | MKN-45 (Gastric adenocarcinoma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80285-2-O | MOLT-4 (Acute T-lymphoblastic leukemia cells) (cluster #2 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80354-4-O | OVCAR-3 (Ovarian adenocarcinoma cells) (cluster #4 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80367-1-O | P388/S (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80418-2-O | RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #2 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80433-1-O | RPMI-8226 (Multiple myeloma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80466-1-O | SF268 (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80526-1-O | SW480 (Colon adenocarcinoma cells) (cluster #1 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80532-1-O | T-24 (Bladder carcinoma cells) (cluster #1 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80896-1-O | NCI-H69 (Small cell lung carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-3-O | HCT-116 (Colon carcinoma cells) (cluster #3 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80957-1-O | HMEC (Microvascular endothelial cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-2-O | HepG2 (Hepatoblastoma cells) (cluster #2 of 8) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-3-O | HepG2 (Hepatoblastoma cells) (cluster #3 of 8) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-3-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #3 of 8) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-3-O | A2780 (Ovarian carcinoma cells) (cluster #3 of 10) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81068-1-O | Ishikawa (Uterine carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-8-O | Jurkat (Acute leukemic T-cells) (cluster #8 of 10) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81133-1-O | L1210 (1565) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-2-O | HeLa (Cervical adenocarcinoma cells) (cluster #2 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81264-1-O | V79 (Lung fibroblasts) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA1R-1-E | Adenosine A1 receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA2AR-1-E | Adenosine A2a receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA3R-1-E | Adenosine A3 receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACES-1-E | Acetylcholinesterase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY2-1-E | Adenylate cyclase type II (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AKT1-1-E | Serine/threonine-protein kinase AKT (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ANDR-1-E | Androgen Receptor (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ANDR-3-E | Androgen Receptor (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BLAT-1-B | Beta-lactamase TEM (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH2-1-E | Carbonic anhydrase II (cluster #1 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 |
| ERBB2-1-E | Receptor protein-tyrosine kinase erbB-2 (cluster #1 of 3) | Eukaryotes | 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 |
| ESR1-1-E | Estrogen receptor alpha (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ESR2-2-E | Estrogen receptor beta (cluster #2 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 |
| GABR1-1-E | GABA-B receptor 1 (cluster #1 of 1) | 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 |
| GBRA2-4-E | GABA receptor alpha-2 subunit (cluster #4 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 |
| GBRA5-4-E | GABA receptor alpha-5 subunit (cluster #4 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 |
| GBRG2-2-E | GABA receptor gamma-2 subunit (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR1-4-E | GABA receptor rho-1 subunit (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR2-2-E | GABA receptor rho-2 subunit (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRR3-1-E | GABA receptor rho-3 subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA4-2-E | Glutamate receptor ionotropic, AMPA 4 (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM2-1-E | Metabotropic glutamate receptor 2 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM3-1-E | Metabotropic glutamate receptor 3 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM4-1-E | Metabotropic glutamate receptor 4 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM5-5-E | Metabotropic glutamate receptor 5 (cluster #5 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM6-1-E | Metabotropic glutamate receptor 6 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HCAR2-2-E | HM74 nicotinic acid GPCR (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDA10-1-E | Histone deacetylase 10 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDA11-1-E | Histone deacetylase 11 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC1-1-E | Histone deacetylase 1 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC2-1-E | Histone deacetylase 2 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC3-1-E | Histone deacetylase 3 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC4-1-E | Histone deacetylase 4 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC5-1-E | Histone deacetylase 5 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC6-1-E | Histone deacetylase 6 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC7-1-E | Histone deacetylase 7 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC8-1-E | Histone deacetylase 8 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC9-1-E | Histone deacetylase 9 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KITH-1-E | Thymidine kinase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KPCB-1-E | Protein kinase C beta (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LCK-1-E | Tyrosine-protein kinase LCK (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDFA-1-B | Multidrug translocase mdfA (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE1-1-E | Glutamate [NMDA] receptor subunit epsilon 1 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDZ1-1-E | Glutamate (NMDA) receptor subunit zeta 1 (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RY2-1-E | Purinergic receptor P2Y2 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RY6-1-E | Pyrimidinergic receptor P2Y6 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2Y14-1-E | P2Y purinoceptor 14 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGH1-1-E | Cyclooxygenase-1 (cluster #1 of 2) | 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 |
| S6A11-2-E | GABA transporter 3 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A12-1-E | Betaine transporter (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A13-2-E | GABA transporter 2 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A1-1-E | GABA transporter 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TLR2-1-E | Toll-like receptor 2 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TOP1-1-E | DNA topoisomerase I (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TOP2A-1-E | DNA topoisomerase II alpha (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TOP2B-1-E | DNA topoisomerase II beta (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100201-1-O | Splenocytes (Spleen cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100500-2-O | 4T1 (Mammary carcinoma cells) (cluster #2 of 2) | 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 |
| Z100766-1-O | Radical scavenging activity (cluster #1 of 2) | 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 |
| Z101821-2-O | H2N2 subtype (cluster #2 of 3) | 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 |
| Z102131-1-O | Vaccinia virus Copenhagen (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102306-4-O | Aorta (cluster #4 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102317-1-O | Brain (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102380-1-O | Ileum (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103203-1-O | A375 (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103205-1-O | A431 (cluster #1 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 |
| Z103359-1-O | NCI-H661 (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 |
| Z50076-1-O | Poliovirus (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50185-3-O | Staphylococcus aureus (cluster #3 of 4) | 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 |
| Z50212-7-O | Escherichia coli (cluster #7 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50278-1-O | Bacillus subtilis (cluster #1 of 2) | 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 |
| Z50347-3-O | Saccharomyces cerevisiae (cluster #3 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 |
| Z50418-2-O | Trypanosoma brucei (cluster #2 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-11-O | Plasmodium falciparum (cluster #11 of 22) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-15-O | Plasmodium falciparum (cluster #15 of 22) | 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 |
| Z50425-4-O | Plasmodium falciparum (cluster #4 of 22) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-8-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #8 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-1-O | Leishmania donovani (cluster #1 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-2-O | Leishmania donovani (cluster #2 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50460-3-O | Leishmania major (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-5-O | Trypanosoma cruzi (cluster #5 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50467-1-O | Trichomonas vaginalis (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-1-O | Cavia porcellus (cluster #1 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50518-2-O | Human herpesvirus 4 (cluster #2 of 5) | 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 |
| Z50587-1-O | Homo sapiens (cluster #1 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50588-2-O | Canis familiaris (cluster #2 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50588-6-O | Canis familiaris (cluster #6 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-3-O | Oryctolagus cuniculus (cluster #3 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-8-O | Mus musculus (cluster #8 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-1-O | Rattus norvegicus (cluster #1 of 12) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-11-O | Rattus norvegicus (cluster #11 of 12) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-8-O | Rattus norvegicus (cluster #8 of 12) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50599-1-O | Cowpox virus (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50600-1-O | Vaccinia virus (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50602-2-O | Human herpesvirus 1 (cluster #2 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50606-1-O | Hepatitis B virus (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50622-2-O | Human rhinovirus 1B (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50643-1-O | Hepatitis C virus (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50643-2-O | Hepatitis C virus (cluster #2 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50652-3-O | Influenza A virus (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80008-1-O | 5637 (Epithelial bladder carcinoma cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80014-1-O | A204 (Rhabdomyosarcoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80018-2-O | A-375 (Malignant melanoma cells) (cluster #2 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80021-4-O | A498 (Renal carcinoma cells) (cluster #4 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80026-1-O | AGS (Gastric adenocarcinoma cells) (cluster #1 of 2) | 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 |
| Z80037-1-O | Balb/MK (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80052-1-O | C8166 (Leukemic T-cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80054-1-O | Caco-2 (Colon adenocarcinoma cells) (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80055-1-O | CAKI-1 (Kidney carcinoma cells) (cluster #1 of 2) | 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 |
| Z80064-2-O | CCRF-CEM (T-cell leukemia) (cluster #2 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-8-O | CCRF-CEM (T-cell leukemia) (cluster #8 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80068-1-O | CCRF-SB (Lymphoblastic leukemia cells) (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80068-3-O | CCRF-SB (Lymphoblastic leukemia cells) (cluster #3 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80076-1-O | CEM-SS (T-cell leukemia) (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80089-1-O | CHO-AA8 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80092-1-O | CHO-K1 (Ovarian 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 |
| Z80115-1-O | DC3F (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80117-1-O | DC3F/AD-II (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80120-1-O | DLD-1 (Colon adenocarcinoma cells) (cluster #1 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 |
| Z80125-8-O | DU-145 (Prostate carcinoma) (cluster #8 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80126-2-O | DuPro (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80133-1-O | EMT6 (Mammary carcinoma cells) (cluster #1 of 3) | 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 |
| Z80136-1-O | FM3A (Breast carcinoma cells) (cluster #1 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80136-5-O | FM3A (Breast carcinoma cells) (cluster #5 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80138-1-O | G-361 (Melanoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80145-3-O | H69 (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-12-O | HL-60 (Promyeloblast leukemia cells) (cluster #12 of 12) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80164-1-O | HT-1080 (Fibrosarcoma cells) (cluster #1 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80164-2-O | HT-1080 (Fibrosarcoma cells) (cluster #2 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80175-1-O | IMR-32 (Neuroblastoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80211-5-O | LoVo (Colon adenocarcinoma cells) (cluster #5 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80214-2-O | M14 (Melanoma cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-12-O | MCF7 (Breast carcinoma cells) (cluster #12 of 14) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-2-O | MCF7 (Breast carcinoma cells) (cluster #2 of 14) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-6-O | MCF7 (Breast carcinoma cells) (cluster #6 of 14) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-7-O | MCF7 (Breast carcinoma cells) (cluster #7 of 14) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80243-1-O | MDA-MB-453 (Breast adenocarcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-3-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #3 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-4-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #4 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80267-1-O | MKN-1 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80277-1-O | MM96L (Melanoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80291-1-O | MRC5 (Embryonic lung fibroblast cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-6-O | MT4 (Lymphocytes) (cluster #6 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-8-O | MT4 (Lymphocytes) (cluster #8 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80322-2-O | NCI-H358 (Lung carcinama cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80330-1-O | NCI-N87 (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 |
| Z80342-1-O | NSCLC (Non-small cell lung carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80354-1-O | OVCAR-3 (Ovarian adenocarcinoma cells) (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-6-O | P388 (Lymphoma cells) (cluster #6 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80389-1-O | PC-14 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-3-O | PC-3 (Prostate carcinoma cells) (cluster #3 of 10) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80391-1-O | PC-6 (Small cell lung carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80414-1-O | Raji (B-lymphoblastic cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80418-1-O | RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #1 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80441-1-O | RXF 944 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80466-2-O | SF268 (cluster #2 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80468-1-O | SF-295 (Glioblastoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80470-1-O | SGC-7901 (Gastric carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80472-1-O | SiHa (Cervical squamous cell carcinoma) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80475-2-O | SK-BR-3 (Breast adenocarcinoma) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80477-1-O | SK_HEP1 (Hepatoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80479-1-O | SK-MEL (Melanoma cells) (cluster #1 of 1) | 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 |
| Z80482-3-O | SK-MEL-2 (Melanoma cells) (cluster #3 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 |
| Z80485-3-O | SK-MEL-28 (Melanoma cells) (cluster #3 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 |
| Z80490-3-O | SK-MES-1 (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80491-2-O | SK-N-MC (Neuroepithelioma cells) (cluster #2 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 |
| Z80492-1-O | SK-N-SH (Neuroblastoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80492-2-O | SK-N-SH (Neuroblastoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80493-1-O | SK-OV-3 (Ovarian carcinoma cells) (cluster #1 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80495-1-O | SK-VLB (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80503-1-O | SNU1 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80509-1-O | SNU-638 (Gastric carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80513-1-O | SQ20B (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80525-1-O | SW48 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80532-3-O | T-24 (Bladder carcinoma cells) (cluster #3 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80548-2-O | THP-1 (Acute monocytic leukemia cells) (cluster #2 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80559-1-O | U251 (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80560-1-O | U-251 (Glioma cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80563-1-O | U-373 MG ( Glioblastoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80565-1-O | U-87 MG (Glioblastoma cells) (cluster #1 of 2) | 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 |
| Z80578-1-O | UV4 (cluster #1 of 1) | 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 |
| Z80585-1-O | WALKER (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80595-1-O | WIL2-NS (Lymphoblastoid cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80600-2-O | XF498 (Glioma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80606-1-O | YOSHIDA (Sarcoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80608-1-O | ZR-75-1 (Breast carcinoma cells) (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80640-1-O | 786-0 (Renal carcinoma cells) (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 |
| Z80661-1-O | A704 (Renal carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80667-1-O | AA8 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-7-O | A549 (Lung carcinoma cells) (cluster #7 of 11) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-8-O | A549 (Lung carcinoma cells) (cluster #8 of 11) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80697-1-O | Bel-7402 (Hepatoma cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80697-3-O | Bel-7402 (Hepatoma cells) (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80711-2-O | NCI/ADR-RES (Breast carcinoma cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80725-1-O | C180-13S (Ovarian carcinoma cells) (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 |
| Z80735-1-O | C38 (Colon carcinoma) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80776-1-O | Clone 62 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80784-1-O | Col2 (Colon carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80800-1-O | MIA PaCa-2 (Pancreatic carcinoma cells) (cluster #1 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 |
| Z80819-1-O | J774.2 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80846-1-O | F460pv8/eto cell line (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80852-1-O | A-431 (Epidermoid carcinoma cells) (cluster #1 of 3) | 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 |
| Z80874-1-O | CEM (T-cell leukemia) (cluster #1 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80874-4-O | CEM (T-cell leukemia) (cluster #4 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80877-2-O | NCI-H1299 (Non-small cell lung carcinoma) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80887-1-O | H2981 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80888-1-O | H2987 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80889-1-O | NCI-H322M (Non-small cell lung carcinoma cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-5-O | HCT-116 (Colon carcinoma cells) (cluster #5 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80943-1-O | HEL 299 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80945-2-O | HEp-2 (Laryngeal carcinoma cells) (cluster #2 of 4) | 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 |
| Z80951-1-O | NIH3T3 (Fibroblasts) (cluster #1 of 4) | 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 |
| Z81006-1-O | Human breast 401NL tumor cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-4-O | HepG2 (Hepatoblastoma cells) (cluster #4 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-5-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #5 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-8-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #8 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81025-1-O | Human lung LXF 529L tumor cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81026-1-O | Human lung LXF 629L tumor cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81028-1-O | Human melanoma cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81043-1-O | N592 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81054-1-O | SF-268 (Glioblastoma cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81057-1-O | HUVEC (Umbilical vein endothelial cells) (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81057-3-O | HUVEC (Umbilical vein endothelial cells) (cluster #3 of 4) | 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 |
| Z81072-7-O | Jurkat (Acute leukemic T-cells) (cluster #7 of 10) | 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 |
| Z81115-1-O | KB (Squamous cell carcinoma) (cluster #1 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81134-1-O | L2987 (Lung adenocarcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81135-1-O | L6 (Skeletal muscle myoblast cells) (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81159-1-O | Lewis cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81160-1-O | Lewis lung carcinoma cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81164-1-O | LL cell line (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81167-1-O | LLTC cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81170-1-O | LNCaP (Prostate carcinoma) (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81170-3-O | LNCaP (Prostate carcinoma) (cluster #3 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81184-1-O | LOX IMVI (Melanoma cells) (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81199-1-O | NCI-H446 (Small cell lung carcinoma cells) (cluster #1 of 2) | 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 |
| Z81227-1-O | M-19 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81244-1-O | J774 (Macrophage cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-3-O | HeLa (Cervical adenocarcinoma cells) (cluster #3 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-5-O | HeLa (Cervical adenocarcinoma cells) (cluster #5 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-6-O | HeLa (Cervical adenocarcinoma cells) (cluster #6 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 |
| Z81261-1-O | UACC-375 (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 |
| Z81280-1-O | NCI-H226 (Non-small cell lung carcinoma cells) (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81284-1-O | NCI-H647 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81335-2-O | HCT-15 (Colon adenocarcinoma cells) (cluster #2 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81341-1-O | Tumor cell lines (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |