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 | 73 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-1-O | Rattus norvegicus (cluster #1 of 12) | Other | 42 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-1-O | Cavia porcellus (cluster #1 of 7) | Other | 23 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADRB2-1-E | Beta-2 adrenergic receptor (cluster #1 of 2) | Eukaryotes | 18 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-1-O | Mus musculus (cluster #1 of 9) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-2-O | L1210 (Lymphocytic leukemia cells) (cluster #2 of 12) | Other | 17 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNH2-1-E | HERG (cluster #1 of 2) | Eukaryotes | 15 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A4-1-E | Serotonin transporter (cluster #1 of 1) | Eukaryotes | 14 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A3-1-E | Dopamine transporter (cluster #1 of 1) | Eukaryotes | 12 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-11-O | Plasmodium falciparum (cluster #11 of 22) | Other | 11 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADRB1-1-E | Beta-1 adrenergic receptor (cluster #1 of 1) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9WTR4-1-E | Norepinephrine transporter (cluster #1 of 2) | Eukaryotes | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-1-O | Homo sapiens (cluster #1 of 9) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-12-O | Rattus norvegicus (cluster #12 of 12) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-1-O | CCRF-CEM (T-cell leukemia) (cluster #1 of 9) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-1-O | MCF7 (Breast carcinoma cells) (cluster #1 of 14) | Other | 10 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-1-O | Trypanosoma cruzi (cluster #1 of 8) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80088-1-O | CHO (Ovarian cells) (cluster #1 of 4) | Other | 9 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1A-1-E | Alpha-1a adrenergic receptor (cluster #1 of 2) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH1-1-E | Histamine H1 receptor (cluster #1 of 2) | Eukaryotes | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50038-1-O | Plasmodium yoelii yoelii (cluster #1 of 2) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-1-O | Plasmodium falciparum (cluster #1 of 22) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-3-O | Oryctolagus cuniculus (cluster #3 of 8) | Other | 8 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM1-1-E | Muscarinic acetylcholine receptor M1 (cluster #1 of 3) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1D-1-E | Alpha-1d adrenergic receptor (cluster #1 of 4) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADRB3-1-E | Beta-3 adrenergic receptor (cluster #1 of 1) | Eukaryotes | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80874-1-O | CEM (T-cell leukemia) (cluster #1 of 7) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH2-1-E | Carbonic anhydrase II (cluster #1 of 2) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ESR2-1-E | Estrogen receptor beta (cluster #1 of 2) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDR1-1-E | P-glycoprotein 1 (cluster #1 of 2) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARG-2-E | Peroxisome proliferator-activated receptor gamma (cluster #2 of 2) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-9-O | Plasmodium falciparum (cluster #9 of 22) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-4-O | Homo sapiens (cluster #4 of 9) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50607-1-O | Human immunodeficiency virus 1 (cluster #1 of 10) | Other | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2C-1-E | 5-hydroxytryptamine receptor 2C (cluster #1 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD1-1-E | Dopamine D1 receptor (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD2-1-E | Dopamine D2 receptor (cluster #1 of 1) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HRH2-1-E | Histamine H2 receptor (cluster #1 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRM-1-E | Mu opioid receptor (cluster #1 of 2) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50212-1-O | Escherichia coli (cluster #1 of 7) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-2-O | Plasmodium falciparum (cluster #2 of 22) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50606-1-O | Hepatitis B virus (cluster #1 of 3) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-6-O | CCRF-CEM (T-cell leukemia) (cluster #6 of 9) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80164-4-O | HT-1080 (Fibrosarcoma cells) (cluster #4 of 6) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80208-1-O | L5178Y (Lymphoma cells) (cluster #1 of 2) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-1-O | A549 (Lung carcinoma cells) (cluster #1 of 11) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-9-O | A549 (Lung carcinoma cells) (cluster #9 of 11) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-1-O | HCT-116 (Colon carcinoma cells) (cluster #1 of 9) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81057-1-O | HUVEC (Umbilical vein endothelial cells) (cluster #1 of 4) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81138-1-O | ScN2a (Scrapie-infected neuroblastoma cells) (cluster #1 of 3) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-2-O | HeLa (Cervical adenocarcinoma cells) (cluster #2 of 9) | Other | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH4-1-E | Carbonic anhydrase IV (cluster #1 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNH2-2-E | HERG (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDR3-1-E | P-glycoprotein 3 (cluster #1 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A2-1-E | Norepinephrine transporter (cluster #1 of 3) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TAAR1-2-E | Trace amine-associated receptor 1 (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50339-1-O | Pneumocystis carinii (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50362-1-O | Lactobacillus casei (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50380-1-O | Mycobacterium smegmatis (cluster #1 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-1-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #1 of 9) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-6-O | Mus musculus (cluster #6 of 9) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50602-2-O | Human herpesvirus 1 (cluster #2 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80006-1-O | 3T3-L1 (Fibroblast cells) (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80101-2-O | COLO 320DM (Colon adenocarcinoma cells) (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80120-3-O | DLD-1 (Colon adenocarcinoma cells) (cluster #3 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80186-1-O | K562 (Erythroleukemia cells) (cluster #1 of 11) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80211-1-O | LoVo (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80268-2-O | MKN-28 (Gastric epithelial carcinoma cells) (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80269-3-O | MKN-45 (Gastric adenocarcinoma cells) (cluster #3 of 3) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80285-2-O | MOLT-4 (Acute T-lymphoblastic leukemia cells) (cluster #2 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80295-2-O | MT4 (Lymphocytes) (cluster #2 of 8) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80347-2-O | NUGC-3 (Gastric carcinoma cells) (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80457-1-O | SCC-25 (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80459-1-O | SCC-7 (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80525-2-O | SW48 (cluster #2 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80532-1-O | T-24 (Bladder carcinoma cells) (cluster #1 of 6) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80583-1-O | Vero (Kidney cells) (cluster #1 of 7) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80686-1-O | AZ-521 cell line (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80792-1-O | Colon 26 (Colon adenocarcinoma cells) (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80936-1-O | HEK293 (Embryonic kidney fibroblasts) (cluster #1 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80945-1-O | HEp-2 (Laryngeal carcinoma cells) (cluster #1 of 4) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81048-1-O | TSU (Prostatic carcinoma cells) (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81121-1-O | KKLS cell line (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81137-1-O | L929 (Fibroblast cells) (cluster #1 of 2) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81170-4-O | LNCaP (Prostate carcinoma) (cluster #4 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81330-1-O | SNU- (cluster #1 of 1) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81335-3-O | HCT-15 (Colon adenocarcinoma cells) (cluster #3 of 5) | Other | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1B-2-E | Serotonin 1b (5-HT1b) receptor (cluster #2 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1D-1-E | Serotonin 1d (5-HT1d) receptor (cluster #1 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM3-1-E | Muscarinic acetylcholine receptor M3 (cluster #1 of 3) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM4-1-E | Muscarinic acetylcholine receptor M4 (cluster #1 of 3) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1B-1-E | Alpha-1b adrenergic receptor (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY2-1-E | Adenylate cyclase type II (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY8-1-E | Adenylate cyclase type VIII (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 |
| DRD3-1-E | Dopamine D3 receptor (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ESR1-1-E | Estrogen receptor alpha (cluster #1 of 3) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MDR1-2-E | P-glycoprotein 1 (cluster #2 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R2-1-E | Prostanoid EP2 receptor (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGH2-1-E | Cyclooxygenase-2 (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q72547-1-V | Human immunodeficiency virus type 1 reverse transcriptase (cluster #1 of 1) | Viruses | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101822-2-O | H3N2 subtype (cluster #2 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104301-1-O | GABA-A receptor; anion channel (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50416-1-O | Aspergillus fumigatus (cluster #1 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50418-5-O | Trypanosoma brucei (cluster #5 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-7-O | Plasmodium falciparum (cluster #7 of 22) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-6-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #6 of 9) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50442-1-O | Candida albicans (cluster #1 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50452-1-O | Trichophyton rubrum (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50459-2-O | Leishmania donovani (cluster #2 of 8) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-4-O | Trypanosoma cruzi (cluster #4 of 8) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50473-4-O | Plasmodium berghei (cluster #4 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50588-6-O | Canis familiaris (cluster #6 of 7) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50652-2-O | Influenza A virus (cluster #2 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50658-1-O | Human immunodeficiency virus 2 (cluster #1 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50677-1-O | Human immunodeficiency virus (cluster #1 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80052-1-O | C8166 (Leukemic T-cells) (cluster #1 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80112-1-O | DAN-G (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-2-O | HL-60 (Promyeloblast leukemia cells) (cluster #2 of 12) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-12-O | HT-29 (Colon adenocarcinoma cells) (cluster #12 of 12) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80171-1-O | HuTu80 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-3-O | P388 (Lymphoma cells) (cluster #3 of 8) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-3-O | PC-3 (Prostate carcinoma cells) (cluster #3 of 10) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80409-1-O | R2 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80414-1-O | Raji (B-lymphoblastic cells) (cluster #1 of 3) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80561-1-O | U2OS (Osteosarcoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80563-1-O | U-373 MG ( Glioblastoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80565-1-O | U-87 MG (Glioblastoma cells) (cluster #1 of 2) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80578-1-O | UV4 (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80815-1-O | D54 cell line (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80830-1-O | Ehrlich (Ehrlich ascites carcinoma cells) (cluster #1 of 1) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-1-O | HepG2 (Hepatoblastoma cells) (cluster #1 of 8) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81115-2-O | KB (Squamous cell carcinoma) (cluster #2 of 6) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81135-4-O | L6 (Skeletal muscle myoblast cells) (cluster #4 of 4) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81247-1-O | HeLa (Cervical adenocarcinoma cells) (cluster #1 of 9) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81281-1-O | NCI-H23 (Non-small cell lung carcinoma cells) (cluster #1 of 5) | Other | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2A-2-E | Serotonin 2a (5-HT2a) receptor (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT3A-1-E | Serotonin 3a (5-HT3a) receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT4R-1-E | Serotonin 4 (5-HT4) receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA3-2-E | Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHB2-1-E | Neuronal acetylcholine receptor protein beta-2 subunit (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHB4-1-E | Neuronal acetylcholine receptor protein beta-4 subunit (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY1-1-E | Brain adenylate cyclase 1 (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGTR1-1-E | Angiotensin II type 1a (AT-1a) receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGTR2-1-E | Angiotensin II type 2 (AT-2) receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ANDR-3-E | Androgen Receptor (cluster #3 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ATP4A-1-E | Potassium-transporting ATPase alpha chain 1 (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ATP4B-1-E | Potassium-transporting ATPase beta chain (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| BLAT-1-B | Beta-lactamase TEM (cluster #1 of 1) | Bacteria | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1C-1-E | Voltage-gated L-type calcium channel alpha-1C subunit (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1D-1-E | Voltage-gated L-type calcium channel alpha-1D subunit (cluster #1 of 1) | 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 |
| CLTR1-1-E | Cysteinyl leukotriene receptor 1 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CXCR4-1-E | C-X-C chemokine receptor type 4 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD4-1-E | Dopamine D4 receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD5-1-E | Dopamine D5 receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRTS-1-E | Dihydrofolate reductase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DYR-1-B | Dihydrofolate reductase (cluster #1 of 1) | Bacteria | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ESR1-2-E | Estrogen receptor alpha (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA1-4-E | GABA receptor alpha-1 subunit (cluster #4 of 5) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG2-1-E | GABA receptor gamma-2 subunit (cluster #1 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 |
| GRM6-2-E | Metabotropic glutamate receptor 6 (cluster #2 of 2) | 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 |
| ITA5-1-E | Fibronectin receptor alpha (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LKHA4-1-E | Leukotriene A4 hydrolase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX5-2-E | Arachidonate 5-lipoxygenase (cluster #2 of 7) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P97706-1-E | Sodium channel protein type VI alpha subunit (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R4-1-E | Prostanoid EP4 receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGH1-1-E | Cyclooxygenase-1 (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PI2R-1-E | Prostanoid IP receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARA-1-E | Peroxisome proliferator-activated receptor alpha (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PRGR-1-E | Progesterone receptor (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PRGR-2-E | Progesterone receptor (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A11-1-E | GABA transporter 3 (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A13-1-E | GABA transporter 2 (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A2-2-E | Norepinephrine transporter (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN5A-1-E | Sodium channel protein type V alpha subunit (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SCN8A-1-E | Sodium channel protein type VIII alpha subunit (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SGMR1-1-E | Sigma opioid receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100733-1-O | CT26 (Colon carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100741-2-O | MC9 (Mast cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102121-2-O | Trichophyton mentagrophytes (cluster #2 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103204-1-O | A427 (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103204-2-O | A427 (cluster #2 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104282-1-O | Acetylcholine receptor; alpha1/beta1/delta/gamma (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104288-1-O | Neuronal acetylcholine receptor; alpha3/beta4 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104304-1-O | Adrenergic receptor alpha-1 (cluster #1 of 1) | 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 |
| Z50046-1-O | Trichophyton quinckeanum (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 |
| Z50142-2-O | Influenza A virus (A/PR/8/34(H1N1)) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50266-1-O | Enterococcus faecium (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50408-1-O | Issatchenkia orientalis (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50409-1-O | Kluyveromyces marxianus (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50418-3-O | Trypanosoma brucei (cluster #3 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50426-9-O | Plasmodium falciparum (isolate K1 / Thailand) (cluster #9 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50443-1-O | Candida glabrata (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50466-2-O | Trypanosoma cruzi (cluster #2 of 8) | 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 |
| Z50472-1-O | Toxoplasma gondii (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50472-2-O | Toxoplasma gondii (cluster #2 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-5-O | Cavia porcellus (cluster #5 of 7) | 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 |
| Z50518-2-O | Human herpesvirus 4 (cluster #2 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50518-3-O | Human herpesvirus 4 (cluster #3 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-3-O | Homo sapiens (cluster #3 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50589-1-O | Felis catus (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50590-1-O | Sus scrofa (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-1-O | Oryctolagus cuniculus (cluster #1 of 8) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-7-O | Rattus norvegicus (cluster #7 of 12) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50600-1-O | Vaccinia virus (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50681-1-O | Duck hepatitis B virus (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50725-1-O | Trypanosoma brucei rhodesiense (cluster #1 of 7) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80001-1-O | 143B (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80008-1-O | 5637 (Epithelial bladder carcinoma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80025-1-O | ACHN (Renal adenocarcinoma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80035-2-O | B16 (Melanoma cells) (cluster #2 of 7) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80054-1-O | Caco-2 (Colon adenocarcinoma cells) (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80063-1-O | CCRF S-180 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80076-1-O | CEM-SS (T-cell leukemia) (cluster #1 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 |
| Z80089-1-O | CHO-AA8 (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80099-1-O | COLO 205 (Colon adenocarcinoma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80106-1-O | COS-1 (Kidney cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80125-1-O | DU-145 (Prostate carcinoma) (cluster #1 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80132-1-O | EL4 (Thymoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80152-1-O | HCT-8 (Ileocecal adenocarcinoma) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-1-O | HT-29 (Colon adenocarcinoma cells) (cluster #1 of 12) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80169-1-O | Huh-7 (Hepatocellular carcinoma) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80192-1-O | KM12 (Colon adenocarcinoma cells) (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-10-O | L1210 (Lymphocytic leukemia cells) (cluster #10 of 12) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80211-2-O | LoVo (Colon adenocarcinoma cells) (cluster #2 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80211-5-O | LoVo (Colon adenocarcinoma cells) (cluster #5 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80214-1-O | M14 (Melanoma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-2-O | MCF7 (Breast carcinoma cells) (cluster #2 of 14) | 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 |
| Z80231-2-O | MCF7S (Breast carcinoma cells) (cluster #2 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80243-1-O | MDA-MB-453 (Breast adenocarcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80285-1-O | MOLT-4 (Acute T-lymphoblastic leukemia cells) (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80294-1-O | MT2 (Lymphocytes) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80354-1-O | OVCAR-3 (Ovarian adenocarcinoma cells) (cluster #1 of 4) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80356-1-O | OVCAR-5 (Ovarian adenocarcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80357-1-O | OVCAR-8 (Ovarian adenocarcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-1-O | P388 (Lymphoma cells) (cluster #1 of 8) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80362-8-O | P388 (Lymphoma cells) (cluster #8 of 8) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-1-O | PC-3 (Prostate carcinoma cells) (cluster #1 of 10) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80407-1-O | R1 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80408-1-O | R1-CCRF-CEM (Lymphoblastic leukemia) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80410-1-O | R2-CCRF-CEM (Lymphoblastic leukemia) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80411-1-O | R30dm-CCRF-CEM (Lymphoblastic leukemia) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80419-1-O | RBL-1 (Basophilic leukemia cells) (cluster #1 of 2) | 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 |
| Z80443-1-O | S180 (Sarcoma 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 |
| Z80468-1-O | SF-295 (Glioblastoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80488-2-O | SK-MEL-5 (Melanoma cells) (cluster #2 of 3) | 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 |
| Z80560-1-O | U-251 (Glioma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80566-1-O | U-937 (Histiocytic lymphoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80568-1-O | UACC-257 (Melanoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80570-3-O | UACC-62 (Melanoma cells) (cluster #3 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80575-1-O | UO-31 (Renal carcinoma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80640-1-O | 786-0 (Renal carcinoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80657-1-O | A253 cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80667-1-O | AA8 (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80682-11-O | A549 (Lung carcinoma cells) (cluster #11 of 11) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80711-1-O | NCI/ADR-RES (Breast carcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80752-1-O | carcinoma cell line (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80789-1-O | Colon 38 (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80847-1-O | FaDu (Pharyngeal carcinoma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80890-1-O | H350.3 (MTX-resistant Reuber hepatoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80893-1-O | H35 (Reuber hepatoma cells) (cluster #1 of 1) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80902-1-O | HASMC (Aortic smooth muscle cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80920-1-O | HCC 2998 (Colon adenocarcinoma cells) (cluster #1 of 2) | 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 |
| Z81017-1-O | WiDr (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81024-1-O | NCI-H460 (Non-small cell lung carcinoma) (cluster #1 of 8) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81054-1-O | SF-268 (Glioblastoma cells) (cluster #1 of 3) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81065-1-O | IGROV-1 (Ovarian adenocarcinoma cells) (cluster #1 of 3) | 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 |
| Z81072-6-O | Jurkat (Acute leukemic T-cells) (cluster #6 of 10) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81117-1-O | Keratinocytes (Keratinocytes) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81170-1-O | LNCaP (Prostate carcinoma) (cluster #1 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81184-1-O | LOX IMVI (Melanoma cells) (cluster #1 of 5) | 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 |
| Z81247-7-O | HeLa (Cervical adenocarcinoma cells) (cluster #7 of 9) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-3-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #3 of 11) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81283-1-O | NCI-H522 (Non-small cell lung carcinoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81322-1-O | SF-539 (Glioblastoma cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81325-1-O | SR (Leukemia cells) (cluster #1 of 2) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81331-1-O | SW-620 (Colon adenocarcinoma cells) (cluster #1 of 6) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81335-1-O | HCT-15 (Colon adenocarcinoma cells) (cluster #1 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1A-2-E | Serotonin 1a (5-HT1a) receptor (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1B-1-E | Serotonin 1b (5-HT1b) receptor (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT1F-1-E | Serotonin 1f (5-HT1f) receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2A-1-E | Serotonin 2a (5-HT2a) receptor (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5HT2B-2-E | Serotonin 2b (5-HT2b) receptor (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ABCC8-1-E | Sulfonylurea receptor 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM1-2-E | Muscarinic acetylcholine receptor M1 (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM2-2-E | Muscarinic acetylcholine receptor M2 (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACM5-2-E | Muscarinic acetylcholine receptor M5 (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1A-2-E | Alpha-1a adrenergic receptor (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1D-4-E | Alpha-1d adrenergic receptor (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2A-1-E | Alpha-2a adrenergic receptor (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2A-3-E | Alpha-2a adrenergic receptor (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2B-1-E | Alpha-2b adrenergic receptor (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2B-2-E | Alpha-2b adrenergic receptor (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2C-1-E | Alpha-2c adrenergic receptor (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2C-3-E | Alpha-2c adrenergic receptor (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY3-1-E | Adenylate cyclase type III (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY4-1-E | Adenylate cyclase type IV (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY5-1-E | Adenylate cyclase type V (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY6-1-E | Adenylate cyclase type VI (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGTRA-1-E | Angiotensin II type 1a (AT-1a) receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGTRB-1-E | Angiotensin II type 1b (AT-1b) receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ALDR-1-E | Aldose reductase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AMPC-1-B | Beta-lactamase (cluster #1 of 1) | Bacteria | 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 |
| C11B1-1-E | Cytochrome P450 11B1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CA2D1-1-E | Voltage-gated calcium channel alpha2/delta subunit 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1B-1-E | Voltage-gated N-type calcium channel alpha-1B subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1G-1-E | Voltage-gated T-type calcium channel alpha-1G subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAC1H-1-E | Voltage-gated T-type calcium channel alpha-1H subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH1-2-E | Carbonic anhydrase I (cluster #2 of 3) | 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 |
| CLTR2-1-E | Cysteinyl leukotriene receptor 2 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| D4A3N4-1-E | Brain adenylate cyclase 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ERR1-1-E | Estrogen-related receptor alpha (cluster #1 of 1) | 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 |
| ERR3-1-E | Estrogen-related receptor gamma (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA1-1-E | GABA receptor alpha-1 subunit (cluster #1 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA2-1-E | GABA receptor alpha-2 subunit (cluster #1 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB1-2-E | GABA receptor beta-1 subunit (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB2-1-E | GABA receptor beta-2 subunit (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG1-2-E | GABA receptor gamma-1 subunit (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GPER-1-E | G-protein coupled estrogen receptor 1 (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 |
| GYRA-1-B | DNA gyrase subunit A (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GYRB-1-B | DNA gyrase subunit B (cluster #1 of 1) | Bacteria | 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 |
| HRH2-2-E | Histamine H2 receptor (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IRK11-1-E | Potassium channel, inwardly rectifying, subfamily J, member 11 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITA2B-2-E | Integrin alpha-IIb (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ITB3-2-E | Integrin beta-3 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNN1-1-E | Small conductance calcium-activated potassium channel protein 1 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNN2-1-E | Small conductance calcium-activated potassium channel protein 2 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KCNN3-1-E | Small conductance calcium-activated potassium channel protein 3 (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 |
| MDR3-2-E | P-glycoprotein 3 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTR1A-1-E | Melatonin receptor 1A (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTR1B-1-E | Melatonin receptor 1B (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTR1C-1-E | Melatonin receptor 1C (cluster #1 of 1) | Eukaryotes | 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 |
| NMDE2-1-E | Glutamate [NMDA] receptor subunit epsilon 2 (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 |
| NMDZ1-2-E | Glutamate (NMDA) receptor subunit zeta 1 (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRD-1-E | Delta opioid receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRK-1-E | Kappa opioid receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PARC-1-B | Topoisomerase IV subunit A (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE1B-1-E | Phosphodiesterase 1B (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE3A-1-E | Phosphodiesterase 3A (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE3B-1-E | Phosphodiesterase 3B (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R1-2-E | Prostanoid EP1 receptor (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PE2R3-2-E | Prostanoid EP3 receptor (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PF2R-1-E | Prostaglandin F2-alpha receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGH1-2-E | Cyclooxygenase-1 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPARG-1-E | Peroxisome proliferator-activated receptor gamma (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q8CFM9-1-E | Adenylate cyclase type VII (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RARA-1-E | Retinoic acid receptor alpha (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RARB-1-E | Retinoic acid receptor beta (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RARG-1-E | Retinoic acid receptor gamma (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RXRA-1-E | Retinoid X receptor alpha (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RXRB-1-E | Retinoid X receptor beta (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| RXRG-2-E | Retinoid X receptor gamma (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TA2R-1-E | Thromboxane A2 receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| THA-1-E | Thyroid hormone receptor alpha (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| THB-1-E | Thyroid hormone receptor beta-1 (cluster #1 of 1) | 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 |
| TRPA1-4-E | Transient receptor potential cation channel subfamily A member 1 (cluster #4 of 6) | 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 |
| TRPV1-1-E | Vanilloid receptor (cluster #1 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100081-1-O | PBMC (Peripheral blood mononuclear cells) (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100081-2-O | PBMC (Peripheral blood mononuclear cells) (cluster #2 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100081-3-O | PBMC (Peripheral blood mononuclear cells) (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100515-1-O | HPAC (Pancreatic adenocarcinoma) (cluster #1 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 |
| Z100715-1-O | Nippostrongylus brasiliensis (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100715-2-O | Nippostrongylus brasiliensis (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100741-1-O | MC9 (Mast cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101682-1-O | BK polyomavirus (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101722-1-O | Chlorella vulgaris (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z101794-1-O | Felid herpesvirus 1 (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 |
| Z101865-1-O | Leishmania chagasi (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 |
| Z102020-1-O | Porcine endogenous retrovirus (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 |
| Z102121-3-O | Trichophyton mentagrophytes (cluster #3 of 3) | 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 |
| Z102213-1-O | Blood (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102306-1-O | Aorta (cluster #1 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102306-2-O | Aorta (cluster #2 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102333-1-O | Ileum (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102380-2-O | Ileum (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z102380-3-O | Ileum (cluster #3 of 3) | 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 |
| Z103192-2-O | Trypanosoma evansi (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103203-1-O | A375 (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103204-4-O | A427 (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z103205-3-O | A431 (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104302-1-O | Glutamate NMDA receptor (cluster #1 of 3) | 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 |
| Z50117-1-O | Pseudomonas aeruginosa (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 |
| Z50274-2-O | Aspergillus flavus (cluster #2 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 |
| Z50278-1-O | Bacillus subtilis (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50309-1-O | Mycobacterium tuberculosis (cluster #1 of 1) | 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 |
| Z50378-1-O | Mycobacterium intracellulare (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50391-1-O | Spinacia oleracea (cluster #1 of 1) | 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 |
| Z50417-1-O | Leishmania infantum (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-1-O | Trypanosoma brucei brucei (cluster #1 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50420-7-O | Trypanosoma brucei brucei (cluster #7 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50422-1-O | Entamoeba histolytica (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50422-2-O | Entamoeba histolytica (cluster #2 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50424-1-O | Cryptosporidium parvum (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-13-O | Plasmodium falciparum (cluster #13 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 |
| Z50425-4-O | Plasmodium falciparum (cluster #4 of 22) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50425-6-O | Plasmodium falciparum (cluster #6 of 22) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50436-1-O | Filobasidiella neoformans (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50444-1-O | Candida parapsilosis (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50457-1-O | Leishmania amazonensis (cluster #1 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 |
| Z50459-1-O | Leishmania donovani (cluster #1 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50460-1-O | Leishmania major (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50460-2-O | Leishmania major (cluster #2 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50460-4-O | Leishmania major (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50461-1-O | Leishmania mexicana (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50467-3-O | Trichomonas vaginalis (cluster #3 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 |
| Z50468-2-O | Giardia intestinalis (cluster #2 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50468-4-O | Giardia intestinalis (cluster #4 of 4) | 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 |
| Z50512-2-O | Cavia porcellus (cluster #2 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50512-3-O | Cavia porcellus (cluster #3 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50515-1-O | Human herpesvirus 2 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50515-2-O | Human herpesvirus 2 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50517-1-O | Human herpesvirus 5 strain AD169 (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50527-1-O | Human herpesvirus 3 (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50527-3-O | Human herpesvirus 3 (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50530-1-O | Human herpesvirus 5 (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50573-1-O | Xenopus laevis (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50574-1-O | Xenopus sp. (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50587-5-O | Homo sapiens (cluster #5 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50591-2-O | Bos taurus (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50592-4-O | Oryctolagus cuniculus (cluster #4 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-4-O | Mus musculus (cluster #4 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50594-7-O | Mus musculus (cluster #7 of 9) | 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 |
| Z50597-9-O | Rattus norvegicus (cluster #9 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 |
| Z50607-5-O | Human immunodeficiency virus 1 (cluster #5 of 10) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50609-1-O | Simian immunodeficiency virus (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50624-1-O | Human adenovirus type 2 (cluster #1 of 1) | 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 |
| 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 |
| Z50658-2-O | Human immunodeficiency virus 2 (cluster #2 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 |
| Z50737-1-O | Human immunodeficiency virus 3 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50740-1-O | Cricetinae gen. sp. (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 |
| Z80005-1-O | 3T3 (Fibroblast cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80005-2-O | 3T3 (Fibroblast cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80008-2-O | 5637 (Epithelial bladder carcinoma cells) (cluster #2 of 3) | 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 |
| Z80019-3-O | A-427 (Lung carcinoma cells) (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80024-2-O | A9 (Fibroblast cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80030-2-O | ANN-1 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80040-1-O | BHK-21 (Kidney cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80064-7-O | CCRF-CEM (T-cell leukemia) (cluster #7 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 |
| Z80067-1-O | CCRF-HSB-2 (T-cell leukemia cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80071-1-O | CEM-0 (T-cell leukemia) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80073-1-O | CEM-c113 (cluster #1 of 1) | 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 |
| Z80084-1-O | CEM-VLB (Vinblastine-resistant T-cell leukemia cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80085-1-O | CEM-VM1 (Etoposide-resistant T-cell leukemia cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80088-3-O | CHO (Ovarian cells) (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80092-2-O | CHO-K1 (Ovarian cells) (cluster #2 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 |
| Z80107-2-O | COS-7 (Kidney 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 |
| Z80115-1-O | DC3F (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80117-2-O | DC3F/AD-II (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80119-1-O | Detroit 98 (cluster #1 of 1) | 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 |
| Z80125-3-O | DU-145 (Prostate carcinoma) (cluster #3 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80133-3-O | EMT6 (Mammary carcinoma cells) (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80135-1-O | F9 (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 |
| Z80156-1-O | HL-60 (Promyeloblast leukemia cells) (cluster #1 of 12) | 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 |
| Z80156-3-O | HL-60 (Promyeloblast leukemia cells) (cluster #3 of 12) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-4-O | HL-60 (Promyeloblast leukemia cells) (cluster #4 of 12) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-5-O | HL-60 (Promyeloblast leukemia cells) (cluster #5 of 12) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80156-6-O | HL-60 (Promyeloblast leukemia cells) (cluster #6 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 |
| Z80164-6-O | HT-1080 (Fibrosarcoma cells) (cluster #6 of 6) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80166-10-O | HT-29 (Colon adenocarcinoma cells) (cluster #10 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 |
| Z80186-6-O | K562 (Erythroleukemia cells) (cluster #6 of 11) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80193-7-O | L1210 (Lymphocytic leukemia cells) (cluster #7 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 |
| Z80224-3-O | MCF7 (Breast carcinoma cells) (cluster #3 of 14) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-5-O | MCF7 (Breast carcinoma cells) (cluster #5 of 14) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80224-9-O | MCF7 (Breast carcinoma cells) (cluster #9 of 14) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80226-1-O | MCF7-2A (cluster #1 of 1) | 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 |
| Z80244-4-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #4 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80244-7-O | MDA-MB-468 (Breast adenocarcinoma) (cluster #7 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 |
| Z80291-2-O | MRC5 (Embryonic lung fibroblast cells) (cluster #2 of 3) | 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 |
| Z80322-1-O | NCI-H358 (Lung carcinama cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80334-1-O | NG108-15 (Neuroblastoma-glioma hybrid cells) (cluster #1 of 1) | 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 |
| Z80377-2-O | PaCa2 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80384-1-O | PBL (Peripheral blood lymphocytes) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80390-8-O | PC-3 (Prostate carcinoma cells) (cluster #8 of 10) | 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 |
| Z80466-1-O | SF268 (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80473-1-O | SISO (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80473-2-O | SISO (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80475-1-O | SK-BR-3 (Breast adenocarcinoma) (cluster #1 of 3) | 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 |
| Z80475-3-O | SK-BR-3 (Breast adenocarcinoma) (cluster #3 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80485-1-O | SK-MEL-28 (Melanoma cells) (cluster #1 of 6) | 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 |
| Z80493-5-O | SK-OV-3 (Ovarian carcinoma cells) (cluster #5 of 6) | 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 |
| Z80516-1-O | SUP-T1 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80530-2-O | Swiss-3T3 (Fibroblast cells) (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80548-1-O | THP-1 (Acute monocytic leukemia cells) (cluster #1 of 5) | 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 |
| Z80583-4-O | Vero (Kidney cells) (cluster #4 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80583-7-O | Vero (Kidney cells) (cluster #7 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80601-1-O | XRS6 (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80604-1-O | YAPC (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80604-2-O | YAPC (cluster #2 of 2) | 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 |
| Z80608-4-O | ZR-75-1 (Breast carcinoma cells) (cluster #4 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80612-1-O | 2008 (Ovarian carcinoma cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80667-2-O | AA8 (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80678-1-O | AMML cell line (cluster #1 of 1) | 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 |
| Z80712-1-O | T47D (Breast carcinoma cells) (cluster #1 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-2-O | T47D (Breast carcinoma cells) (cluster #2 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80712-3-O | T47D (Breast carcinoma cells) (cluster #3 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 |
| Z80737-1-O | C3H/3T3 (Embryonic fibroblast cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80742-1-O | C6 (Glioma cells) (cluster #1 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 |
| Z80768-1-O | CH1 (Ovarian carcinoma cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80773-1-O | CHRC/5 cell line (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80777-1-O | CML/BC 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 |
| Z80807-1-O | D283 cell line (cluster #1 of 1) | 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 |
| Z80846-2-O | F460pv8/eto cell line (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80852-2-O | A-431 (Epidermoid carcinoma cells) (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80874-3-O | CEM (T-cell leukemia) (cluster #3 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 |
| Z80887-1-O | H2981 cell line (cluster #1 of 1) | 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 |
| Z80897-1-O | H9 (T-lymphoid cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80928-2-O | HCT-116 (Colon carcinoma cells) (cluster #2 of 9) | 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 |
| Z80928-6-O | HCT-116 (Colon carcinoma cells) (cluster #6 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80942-1-O | HEL (Embryonic lung cells) (cluster #1 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80947-1-O | Hepatoblastoma cell line (cluster #1 of 1) | 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 |
| Z80954-1-O | HFF (Foreskin fibroblasts) (cluster #1 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z80954-3-O | HFF (Foreskin fibroblasts) (cluster #3 of 4) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81017-5-O | WiDr (Colon adenocarcinoma cells) (cluster #5 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81020-7-O | HepG2 (Hepatoblastoma cells) (cluster #7 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 |
| Z81034-3-O | A2780 (Ovarian carcinoma cells) (cluster #3 of 10) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81034-6-O | A2780 (Ovarian carcinoma cells) (cluster #6 of 10) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-10-O | Jurkat (Acute leukemic T-cells) (cluster #10 of 10) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81072-2-O | Jurkat (Acute leukemic T-cells) (cluster #2 of 10) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81077-1-O | KATO III 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 |
| Z81131-1-O | L cells (Fibroblasts) (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 |
| 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 |
| Z81166-1-O | LLC cell line (cluster #1 of 1) | 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 |
| Z81170-2-O | LNCaP (Prostate carcinoma) (cluster #2 of 5) | 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 |
| 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 |
| Z81223-1-O | M 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 |
| Z81247-5-O | HeLa (Cervical adenocarcinoma cells) (cluster #5 of 9) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-10-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #10 of 11) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-5-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #5 of 11) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-6-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #6 of 11) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81252-9-O | MDA-MB-231 (Breast adenocarcinoma cells) (cluster #9 of 11) | 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 |
| Z81281-5-O | NCI-H23 (Non-small cell lung carcinoma cells) (cluster #5 of 5) | 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 |
| Z81338-1-O | T-cells (cluster #1 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z81346-1-O | Melanophores (Melanophore cells) (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |