UCSF

Lipidomics

Binding 10μM Binding 1μM Functional 10μM ADME/T 10μM

Functional 10μM Targets with Highest Number of Available Compounds (455 in total)

Name (Code) Description Organism Class Size Browse Download (Annotations)
GPBAR-2-E G-protein coupled bile acid receptor 1 (cluster #2 of 2) Eukaryotes 34 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-1-O MCF7 (Breast carcinoma cells) (cluster #1 of 14) Other 19 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-11-O Plasmodium falciparum (cluster #11 of 22) Other 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80418-2-O RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #2 of 9) Other 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-3-O Plasmodium falciparum (cluster #3 of 22) Other 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-4-O Plasmodium falciparum (cluster #4 of 22) Other 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80437-1-O RWLeu4 (cluster #1 of 1) Other 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-2-O HeLa (Cervical adenocarcinoma cells) (cluster #2 of 9) Other 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2-1-E Estrogen receptor beta (cluster #1 of 2) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
NR1H4-2-E Bile acid receptor FXR (cluster #2 of 2) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-4-O Mus musculus (cluster #4 of 9) Other 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80188-1-O KB 3-1 (Cervical epithelial carcinoma cells) (cluster #1 of 2) Other 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1-1-E Estrogen receptor alpha (cluster #1 of 3) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50587-5-O Homo sapiens (cluster #5 of 9) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607-1-O Human immunodeficiency virus 1 (cluster #1 of 10) Other 7 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
Z80224-2-O MCF7 (Breast carcinoma cells) (cluster #2 of 14) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80390-1-O PC-3 (Prostate carcinoma cells) (cluster #1 of 10) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682-1-O A549 (Lung carcinoma cells) (cluster #1 of 11) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR-2-E Androgen Receptor (cluster #2 of 3) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50420-1-O Trypanosoma brucei brucei (cluster #1 of 7) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50592-2-O Oryctolagus cuniculus (cluster #2 of 8) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-1-O Rattus norvegicus (cluster #1 of 12) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-5-O HL-60 (Promyeloblast leukemia cells) (cluster #5 of 12) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81115-2-O KB (Squamous cell carcinoma) (cluster #2 of 6) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50420-3-O Trypanosoma brucei brucei (cluster #3 of 7) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-7-O Mus musculus (cluster #7 of 9) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-1-O HL-60 (Promyeloblast leukemia cells) (cluster #1 of 12) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-12-O HL-60 (Promyeloblast leukemia cells) (cluster #12 of 12) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-1-O HT-29 (Colon adenocarcinoma cells) (cluster #1 of 12) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682-3-O A549 (Lung carcinoma cells) (cluster #3 of 11) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81020-3-O HepG2 (Hepatoblastoma cells) (cluster #3 of 8) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-1-O HeLa (Cervical adenocarcinoma cells) (cluster #1 of 9) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-3-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #3 of 11) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102380-2-O Ileum (cluster #2 of 3) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50518-4-O Human herpesvirus 4 (cluster #4 of 5) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-4-O Rattus norvegicus (cluster #4 of 12) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607-8-O Human immunodeficiency virus 1 (cluster #8 of 10) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50643-1-O Hepatitis C virus (cluster #1 of 5) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80164-2-O HT-1080 (Fibrosarcoma cells) (cluster #2 of 6) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-2-O HT-29 (Colon adenocarcinoma cells) (cluster #2 of 12) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80485-1-O SK-MEL-28 (Melanoma cells) (cluster #1 of 6) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80566-2-O U-937 (Histiocytic lymphoma cells) (cluster #2 of 2) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80712-2-O T47D (Breast carcinoma cells) (cluster #2 of 7) 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
Z80928-6-O HCT-116 (Colon carcinoma cells) (cluster #6 of 9) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81020-2-O HepG2 (Hepatoblastoma cells) (cluster #2 of 8) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81115-1-O KB (Squamous cell carcinoma) (cluster #1 of 6) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR-1-E Androgen Receptor (cluster #1 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MCR-2-E Mineralocorticoid receptor (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
VDR-1-E Vitamin D receptor (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102306-4-O Aorta (cluster #4 of 6) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50573-2-O Xenopus laevis (cluster #2 of 2) 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
Z50607-9-O Human immunodeficiency virus 1 (cluster #9 of 10) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-10-O HT-29 (Colon adenocarcinoma cells) (cluster #10 of 12) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-6-O K562 (Erythroleukemia cells) (cluster #6 of 11) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80285-2-O MOLT-4 (Acute T-lymphoblastic leukemia cells) (cluster #2 of 4) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80466-1-O SF268 (cluster #1 of 4) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80548-2-O THP-1 (Acute monocytic leukemia cells) (cluster #2 of 5) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80548-4-O THP-1 (Acute monocytic leukemia cells) (cluster #4 of 5) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682-6-O A549 (Lung carcinoma cells) (cluster #6 of 11) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80874-1-O CEM (T-cell leukemia) (cluster #1 of 7) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80926-1-O HCT cell lines (cluster #1 of 1) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81020-7-O HepG2 (Hepatoblastoma cells) (cluster #7 of 8) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81068-1-O Ishikawa (Uterine carcinoma cells) (cluster #1 of 1) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81072-1-O Jurkat (Acute leukemic T-cells) (cluster #1 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
Z81245-2-O MDA-MB-435 (Breast carcinoma cells) (cluster #2 of 6) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-4-O HeLa (Cervical adenocarcinoma cells) (cluster #4 of 9) 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
CNR1-1-E Cannabinoid CB1 receptor (cluster #1 of 2) Eukaryotes 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
FFAR1-1-E Free fatty acid receptor 1 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2-2-E GABA receptor gamma-2 subunit (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LASR-1-B Transcriptional activator protein lasR (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5-6-E Arachidonate 5-lipoxygenase (cluster #6 of 7) 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
PI2R-1-E Prostanoid IP receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PTAFR-2-E Platelet activating factor receptor (cluster #2 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9RMS5-1-B PhzR (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARA-1-E Retinoic acid receptor alpha (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARB-1-E Retinoic acid receptor beta (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARG-1-E Retinoic acid receptor gamma (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRA-1-E Retinoid X receptor alpha (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRB-1-E Retinoid X receptor beta (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRG-2-E Retinoid X receptor gamma (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3-1-E Dopamine transporter (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TLR2-1-E Toll-like receptor 2 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPA1-1-E Transient receptor potential cation channel subfamily A member 1 (cluster #1 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPA1-3-E Transient receptor potential cation channel subfamily A member 1 (cluster #3 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPV1-1-E Vanilloid receptor (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPV1-3-E Vanilloid receptor (cluster #3 of 4) 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
Z102121-1-O Trichophyton mentagrophytes (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102178-2-O Liver microsomes (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103203-1-O A375 (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50417-1-O Leishmania infantum (cluster #1 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50436-2-O Filobasidiella neoformans (cluster #2 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50442-2-O Candida albicans (cluster #2 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50452-2-O Trichophyton rubrum (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50457-1-O Leishmania amazonensis (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50459-4-O Leishmania donovani (cluster #4 of 8) 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
Z50587-4-O Homo sapiens (cluster #4 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
Z50594-8-O Mus musculus (cluster #8 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-11-O Rattus norvegicus (cluster #11 of 12) 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
Z50607-4-O Human immunodeficiency virus 1 (cluster #4 of 10) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50652-3-O Influenza A virus (cluster #3 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
Z80021-3-O A498 (Renal carcinoma cells) (cluster #3 of 5) 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
Z80035-1-O B16 (Melanoma cells) (cluster #1 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
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
Z80125-1-O DU-145 (Prostate carcinoma) (cluster #1 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80150-2-O H9c2 (Cardiomyoblast cells) (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-3-O HL-60 (Promyeloblast leukemia cells) (cluster #3 of 12) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-1-O K562 (Erythroleukemia cells) (cluster #1 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-2-O K562 (Erythroleukemia cells) (cluster #2 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-3-O K562 (Erythroleukemia cells) (cluster #3 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-5-O K562 (Erythroleukemia cells) (cluster #5 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193-2-O L1210 (Lymphocytic leukemia cells) (cluster #2 of 12) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193-5-O L1210 (Lymphocytic leukemia cells) (cluster #5 of 12) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
Z80269-1-O MKN-45 (Gastric adenocarcinoma cells) (cluster #1 of 3) 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
Z80362-1-O P388 (Lymphoma cells) (cluster #1 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80364-1-O P388/ADR (Lymphoma cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80390-8-O PC-3 (Prostate carcinoma cells) (cluster #8 of 10) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80418-3-O RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #3 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80427-1-O RKO (Colon carcinoma) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80466-2-O SF268 (cluster #2 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80470-1-O SGC-7901 (Gastric carcinoma cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80475-1-O SK-BR-3 (Breast adenocarcinoma) (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80475-2-O SK-BR-3 (Breast adenocarcinoma) (cluster #2 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80492-1-O SK-N-SH (Neuroblastoma cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80493-2-O SK-OV-3 (Ovarian carcinoma cells) (cluster #2 of 6) 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
Z80583-4-O Vero (Kidney cells) (cluster #4 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80608-1-O ZR-75-1 (Breast carcinoma cells) (cluster #1 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80678-1-O AMML cell line (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80712-1-O T47D (Breast carcinoma cells) (cluster #1 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80777-1-O CML/BC cell line (cluster #1 of 1) 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
Z80901-1-O HaCaT (Keratinocytes) (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
Z80928-4-O HCT-116 (Colon carcinoma cells) (cluster #4 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
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
Z81034-2-O A2780 (Ovarian carcinoma cells) (cluster #2 of 10) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81072-7-O Jurkat (Acute leukemic T-cells) (cluster #7 of 10) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81117-2-O Keratinocytes (Keratinocytes) (cluster #2 of 2) 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
Z81170-1-O LNCaP (Prostate carcinoma) (cluster #1 of 5) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-2-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #2 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL1-2-E Tyrosine-protein kinase ABL (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY1-2-E Brain adenylate cyclase 1 (cluster #2 of 2) 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
ANDR-3-E Androgen Receptor (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BCR-2-E Breakpoint cluster region protein (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR2-1-E Cannabinoid CB2 receptor (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR2-2-E Cannabinoid CB2 receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB1-1-E Estradiol 17-beta-dehydrogenase 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
ESR2-2-E Estrogen receptor beta (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
GBRA1-2-E GABA receptor alpha-1 subunit (cluster #2 of 5) 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
GBRB2-2-E GABA receptor beta-2 subunit (cluster #2 of 2) 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
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
GCR-2-E Glucocorticoid receptor (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
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
LPAR1-2-E Lysophosphatidic acid receptor Edg-2 (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LPAR2-1-E Lysophosphatidic acid receptor Edg-4 (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LPAR3-1-E Lysophosphatidic acid receptor Edg-7 (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LPAR5-1-E Lysophosphatidic acid receptor 5 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LUXR-1-B Transcriptional activator protein luxR (cluster #1 of 2) Bacteria 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
NR1H2-2-E LXR-beta (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NTCP-1-E Bile acid transporter (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
O3FA1-2-E G-protein coupled receptor 120 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXER1-1-E Oxoeicosanoid receptor 1 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2Y12-2-E Purinergic receptor P2Y12 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
PGH1-1-E Cyclooxygenase-1 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARA-1-E Peroxisome proliferator-activated receptor alpha (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRGR-2-E Progesterone receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q862F3-1-E Tubulin alpha chain (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q862L2-1-E Tubulin alpha-1 chain (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S1PR1-3-E Sphingosine 1-phosphate receptor Edg-1 (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S1PR3-1-E Sphingosine 1-phosphate receptor Edg-3 (cluster #1 of 1) Eukaryotes 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
SHBG-1-E Testis-specific androgen-binding protein (cluster #1 of 1) 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
TBB1-1-E Tubulin beta-1 chain (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB2B-1-E Tubulin beta chain (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB3-1-E Tubulin beta-3 chain (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB4A-1-E Tubulin beta-4 chain (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB4B-1-E Tubulin beta-2 chain (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB8-1-E Tubulin beta-8 chain (cluster #1 of 3) 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
TRAR-1-B Transcriptional activator protein traR (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPV2-1-E Transient receptor potential cation channel subfamily V member 2 (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPV4-1-E Transient receptor potential cation channel subfamily V member 4 (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100499-2-O SARS coronavirus (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100733-1-O CT26 (Colon carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101775-1-O Drosophila (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102317-1-O Brain (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102342-1-O Liver (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102380-1-O Ileum (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103196-1-O 22RV1 (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103202-1-O 8505C (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103205-1-O A431 (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103216-1-O C32 (cluster #1 of 1) 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
Z50038-1-O Plasmodium yoelii yoelii (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50136-1-O Plasmodium falciparum (isolate FcB1 / Columbia) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50142-1-O Influenza A virus (A/PR/8/34(H1N1)) (cluster #1 of 2) 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
Z50380-2-O Mycobacterium smegmatis (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50408-2-O Issatchenkia orientalis (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50416-2-O Aspergillus fumigatus (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50418-4-O Trypanosoma brucei (cluster #4 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-1-O Plasmodium falciparum (cluster #1 of 22) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-22-O Plasmodium falciparum (cluster #22 of 22) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-6-O Plasmodium falciparum (cluster #6 of 22) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50426-7-O Plasmodium falciparum (isolate K1 / Thailand) (cluster #7 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50442-3-O Candida albicans (cluster #3 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50444-2-O Candida parapsilosis (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50446-2-O Candida tropicalis (cluster #2 of 2) 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
Z50459-6-O Leishmania donovani (cluster #6 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
Z50460-3-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
Z50472-2-O Toxoplasma gondii (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50512-4-O Cavia porcellus (cluster #4 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50531-3-O Caenorhabditis elegans (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50587-2-O Homo sapiens (cluster #2 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
Z50588-7-O Canis familiaris (cluster #7 of 7) 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
Z50592-1-O Oryctolagus cuniculus (cluster #1 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50592-5-O Oryctolagus cuniculus (cluster #5 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-6-O Rattus norvegicus (cluster #6 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-7-O Rattus norvegicus (cluster #7 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50602-3-O Human herpesvirus 1 (cluster #3 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607-7-O Human immunodeficiency virus 1 (cluster #7 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50611-3-O Moloney murine leukemia virus (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50636-1-O Sindbis virus (cluster #1 of 3) 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
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
Z80017-1-O A2780cisR (Cisplatin-resistant ovarian carcinoma cells) (cluster #1 of 2) 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
Z80026-1-O AGS (Gastric adenocarcinoma cells) (cluster #1 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
Z80039-1-O BGC-823 (Stomach adenocarcinoma cells) (cluster #1 of 2) 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
Z80060-1-O CAPAN-1 (Pancreatic adenocarcinoma cells) (cluster #1 of 1) 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
Z80092-1-O CHO-K1 (Ovarian cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80105-1-O COR-L23 (Lung carcinoma 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
Z80110-2-O CV-1 (Kidney cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80114-1-O Daudi (Burkitts lymphoma cells) (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80123-1-O DO4 (Melanoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80125-9-O DU-145 (Prostate carcinoma) (cluster #9 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
Z80134-1-O EVSA-T (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80135-1-O F9 (cluster #1 of 1) 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
Z80164-1-O HT-1080 (Fibrosarcoma cells) (cluster #1 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
Z80178-1-O J774.A1 (Macrophage cells) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80178-2-O J774.A1 (Macrophage cells) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-4-O K562 (Erythroleukemia cells) (cluster #4 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193-1-O L1210 (Lymphocytic leukemia cells) (cluster #1 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80211-1-O LoVo (Colon adenocarcinoma cells) (cluster #1 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
Z80224-6-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
Z80226-1-O MCF7-2A (cluster #1 of 1) 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
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
Z80359-1-O P19 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80367-1-O P388/S (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80377-2-O PaCa2 (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
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
Z80420-1-O RBL-2H3 (Basophilic leukemia cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80433-1-O RPMI-8226 (Multiple myeloma cells) (cluster #1 of 3) 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
Z80468-1-O SF-295 (Glioblastoma 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
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
Z80482-1-O SK-MEL-2 (Melanoma cells) (cluster #1 of 4) 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
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
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
Z80530-2-O Swiss-3T3 (Fibroblast cells) (cluster #2 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
Z80548-3-O THP-1 (Acute monocytic leukemia cells) (cluster #3 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
Z80581-1-O VA13 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80583-1-O Vero (Kidney cells) (cluster #1 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
Z80640-1-O 786-0 (Renal carcinoma cells) (cluster #1 of 1) 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
Z80682-7-O A549 (Lung carcinoma cells) (cluster #7 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
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
Z80768-1-O CH1 (Ovarian carcinoma cells) (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
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
Z80874-2-O CEM (T-cell leukemia) (cluster #2 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80874-6-O CEM (T-cell leukemia) (cluster #6 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
Z80889-1-O NCI-H322M (Non-small cell lung carcinoma cells) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80897-2-O H9 (T-lymphoid cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80901-2-O HaCaT (Keratinocytes) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80936-1-O HEK293 (Embryonic kidney fibroblasts) (cluster #1 of 4) 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
Z80945-1-O HEp-2 (Laryngeal carcinoma cells) (cluster #1 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
Z80954-3-O HFF (Foreskin fibroblasts) (cluster #3 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81000-1-O HT-22 (Hippocampal cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81005-1-O HTB-54 cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81006-1-O Human breast 401NL tumor cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81011-3-O human cell lines (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81024-3-O NCI-H460 (Non-small cell lung carcinoma) (cluster #3 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
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
Z81034-3-O A2780 (Ovarian carcinoma cells) (cluster #3 of 10) 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
Z81057-2-O HUVEC (Umbilical vein endothelial cells) (cluster #2 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
Z81072-2-O Jurkat (Acute leukemic T-cells) (cluster #2 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81072-3-O Jurkat (Acute leukemic T-cells) (cluster #3 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
Z81115-4-O KB (Squamous cell carcinoma) (cluster #4 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
Z81137-1-O L929 (Fibroblast cells) (cluster #1 of 2) 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
Z81170-2-O LNCaP (Prostate carcinoma) (cluster #2 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
Z81252-4-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #4 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-7-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #7 of 11) 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
Z81298-1-O PE cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81335-1-O HCT-15 (Colon adenocarcinoma cells) (cluster #1 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81335-4-O HCT-15 (Colon adenocarcinoma cells) (cluster #4 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81338-2-O T-cells (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81338-3-O T-cells (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81341-1-O Tumor cell lines (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase