UCSF

Apexmol Building Blocks

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

Functional 10μM Targets with Highest Number of Available Compounds (517 in total)

Name (Code) Description Organism Class Size Browse Download (Annotations)
Z50425-3-O Plasmodium falciparum (cluster #3 of 22) Other 23 Annotations Catalogs SMILES SDF Mol2 Flexibase
TAAR1-2-E Trace amine-associated receptor 1 (cluster #2 of 2) Eukaryotes 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2-2-E HM74 nicotinic acid GPCR (cluster #2 of 3) Eukaryotes 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-1-O Rattus norvegicus (cluster #1 of 12) 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
5HT2C-1-E 5-hydroxytryptamine receptor 2C (cluster #1 of 2) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-1-O Mus musculus (cluster #1 of 9) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-12-O Rattus norvegicus (cluster #12 of 12) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-7-O Rattus norvegicus (cluster #7 of 12) 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
Z80186-1-O K562 (Erythroleukemia cells) (cluster #1 of 11) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193-2-O L1210 (Lymphocytic leukemia cells) (cluster #2 of 12) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50422-3-O Entamoeba histolytica (cluster #3 of 5) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50468-2-O Giardia intestinalis (cluster #2 of 4) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50587-1-O Homo sapiens (cluster #1 of 9) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50592-3-O Oryctolagus cuniculus (cluster #3 of 8) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50606-1-O Hepatitis B virus (cluster #1 of 3) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50677-1-O Human immunodeficiency virus (cluster #1 of 3) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80548-1-O THP-1 (Acute monocytic leukemia cells) (cluster #1 of 5) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682-1-O A549 (Lung carcinoma cells) (cluster #1 of 11) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B-1-E Serotonin 2b (5-HT2b) receptor (cluster #1 of 2) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR-1-E Epidermal growth factor receptor erbB1 (cluster #1 of 2) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2-1-E Cyclooxygenase-2 (cluster #1 of 1) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG-1-E Peroxisome proliferator-activated receptor gamma (cluster #1 of 2) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80928-3-O HCT-116 (Colon carcinoma cells) (cluster #3 of 9) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81020-1-O HepG2 (Hepatoblastoma cells) (cluster #1 of 8) 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
5HT2A-2-E Serotonin 2a (5-HT2a) receptor (cluster #2 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CXCR1-1-E Interleukin-8 receptor A (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CXCR2-1-E C-X-C chemokine receptor type 2 (cluster #1 of 3) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERBB2-2-E Receptor protein-tyrosine kinase erbB-2 (cluster #2 of 3) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY1-1-E P2Y purinoceptor 1 (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1-2-E Cyclooxygenase-1 (cluster #2 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARA-1-E Peroxisome proliferator-activated receptor alpha (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50512-1-O Cavia porcellus (cluster #1 of 7) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80064-1-O CCRF-CEM (T-cell leukemia) (cluster #1 of 9) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-4-O HL-60 (Promyeloblast leukemia cells) (cluster #4 of 12) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-1-O HT-29 (Colon adenocarcinoma cells) (cluster #1 of 12) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80583-7-O Vero (Kidney cells) (cluster #7 of 7) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2-1-E Beta-2 adrenergic receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM6-1-E Metabotropic glutamate receptor 6 (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5-1-E Arachidonate 5-lipoxygenase (cluster #1 of 7) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK11-1-E MAP kinase p38 beta (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK12-1-E MAP kinase p38 gamma (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK13-1-E MAP kinase p38 delta (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK14-1-E MAP kinase p38 alpha (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A11-2-E GABA transporter 3 (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A12-1-E Betaine transporter (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A13-2-E GABA transporter 2 (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A1-1-E GABA transporter 1 (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-10-O Plasmodium falciparum (cluster #10 of 22) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-11-O Plasmodium falciparum (cluster #11 of 22) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-12-O Plasmodium falciparum (cluster #12 of 22) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50602-2-O Human herpesvirus 1 (cluster #2 of 5) 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
Z80156-2-O HL-60 (Promyeloblast leukemia cells) (cluster #2 of 12) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-5-O MCF7 (Breast carcinoma cells) (cluster #5 of 14) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80390-1-O PC-3 (Prostate carcinoma cells) (cluster #1 of 10) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81034-3-O A2780 (Ovarian carcinoma cells) (cluster #3 of 10) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81034-6-O A2780 (Ovarian carcinoma cells) (cluster #6 of 10) 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
Z81247-1-O HeLa (Cervical adenocarcinoma cells) (cluster #1 of 9) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-7-O HeLa (Cervical adenocarcinoma cells) (cluster #7 of 9) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81338-1-O T-cells (cluster #1 of 3) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A-1-E Serotonin 2a (5-HT2a) receptor (cluster #1 of 2) 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
ACM1-1-E Muscarinic acetylcholine receptor M1 (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A-3-E Alpha-2a adrenergic receptor (cluster #3 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B-2-E Alpha-2b adrenergic receptor (cluster #2 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C-3-E Alpha-2c adrenergic receptor (cluster #3 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2-1-E Adenylate cyclase type II (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-1-E Dopamine D2 receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1-1-E Estrogen receptor alpha (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2-1-E Estrogen receptor beta (cluster #1 of 2) 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
GRM4-1-E Metabotropic glutamate receptor 4 (cluster #1 of 1) 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
HRH2-1-E Histamine H2 receptor (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
NTR1-1-E Neurotensin receptor 1 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX1-1-E P2X purinoceptor 1 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX2-1-E P2X purinoceptor 2 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX3-1-E P2X purinoceptor 3 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2Y12-1-E Purinergic receptor P2Y12 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGFRA-1-E Platelet-derived growth factor receptor alpha (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
TNFA-1-E TNF-alpha (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
TS1R2-1-E Taste receptor type 1 member 2 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TS1R3-1-E Taste receptor type 1 member 3 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100081-1-O PBMC (Peripheral blood mononuclear cells) (cluster #1 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100405-1-O MV4-11 (Myeloid leukemia cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100492-1-O MCF10 (Normal breast epithelial cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101822-2-O H3N2 subtype (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102116-1-O Toxoplasma gondii RH (cluster #1 of 2) 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
Z104302-1-O Glutamate NMDA receptor (cluster #1 of 3) 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
Z50142-2-O Influenza A virus (A/PR/8/34(H1N1)) (cluster #2 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
Z50466-1-O Trypanosoma cruzi (cluster #1 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50467-3-O Trichomonas vaginalis (cluster #3 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
Z50530-3-O Human herpesvirus 5 (cluster #3 of 5) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-10-O Rattus norvegicus (cluster #10 of 12) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-8-O Rattus norvegicus (cluster #8 of 12) 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
Z50643-2-O Hepatitis C virus (cluster #2 of 5) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50652-2-O Influenza A virus (cluster #2 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80006-1-O 3T3-L1 (Fibroblast cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80037-1-O Balb/MK (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80064-6-O CCRF-CEM (T-cell leukemia) (cluster #6 of 9) 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
Z80136-1-O FM3A (Breast carcinoma cells) (cluster #1 of 6) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-6-O HL-60 (Promyeloblast leukemia cells) (cluster #6 of 12) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80164-1-O HT-1080 (Fibrosarcoma cells) (cluster #1 of 6) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80164-4-O HT-1080 (Fibrosarcoma cells) (cluster #4 of 6) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-4-O HT-29 (Colon adenocarcinoma cells) (cluster #4 of 12) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-10-O K562 (Erythroleukemia cells) (cluster #10 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80188-1-O KB 3-1 (Cervical epithelial carcinoma cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-9-O MCF7 (Breast carcinoma cells) (cluster #9 of 14) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80244-2-O MDA-MB-468 (Breast adenocarcinoma) (cluster #2 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80295-2-O MT4 (Lymphocytes) (cluster #2 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80322-1-O NCI-H358 (Lung carcinama cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80362-6-O P388 (Lymphoma cells) (cluster #6 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80390-3-O PC-3 (Prostate carcinoma cells) (cluster #3 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
Z80466-4-O SF268 (cluster #4 of 4) 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
Z80475-3-O SK-BR-3 (Breast adenocarcinoma) (cluster #3 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80485-1-O SK-MEL-28 (Melanoma cells) (cluster #1 of 6) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80493-1-O SK-OV-3 (Ovarian carcinoma cells) (cluster #1 of 6) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80493-6-O SK-OV-3 (Ovarian carcinoma cells) (cluster #6 of 6) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80523-1-O SW1353 (cluster #1 of 2) 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
Z80583-1-O Vero (Kidney cells) (cluster #1 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80641-1-O 791T cell line (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682-9-O A549 (Lung carcinoma cells) (cluster #9 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80712-2-O T47D (Breast carcinoma cells) (cluster #2 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80724-1-O C170 cell line (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80874-7-O CEM (T-cell leukemia) (cluster #7 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80877-1-O NCI-H1299 (Non-small cell lung carcinoma) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80928-2-O HCT-116 (Colon carcinoma cells) (cluster #2 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80961-1-O HN5 (Squamous cell carcinoma) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81020-4-O HepG2 (Hepatoblastoma cells) (cluster #4 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81024-8-O NCI-H460 (Non-small cell lung carcinoma) (cluster #8 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81057-1-O HUVEC (Umbilical vein endothelial cells) (cluster #1 of 4) 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
Z81247-2-O HeLa (Cervical adenocarcinoma cells) (cluster #2 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-1-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #1 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-6-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #6 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-9-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #9 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81331-1-O SW-620 (Colon adenocarcinoma cells) (cluster #1 of 6) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B-2-E Serotonin 1b (5-HT1b) receptor (cluster #2 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
5HT2C-2-E 5-hydroxytryptamine receptor 2C (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A-1-E Serotonin 3a (5-HT3a) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B-1-E Serotonin 3b (5-HT3b) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R-1-E Serotonin 4 (5-HT4) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL1-1-E Tyrosine-protein kinase ABL (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES-1-E Acetylcholinesterase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3-1-E Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7-1-E Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7-2-E Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #2 of 4) 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
ACM2-3-E Muscarinic acetylcholine receptor M2 (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3-1-E Muscarinic acetylcholine receptor M3 (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3-3-E Muscarinic acetylcholine receptor M3 (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM4-1-E Muscarinic acetylcholine receptor M4 (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM4-3-E Muscarinic acetylcholine receptor M4 (cluster #3 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
ACM5-3-E Muscarinic acetylcholine receptor M5 (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY1-1-E Brain adenylate cyclase 1 (cluster #1 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
ADCY8-1-E Adenylate cyclase type VIII (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1-1-E Beta-1 adrenergic receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3-1-E Beta-3 adrenergic receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1-1-E Angiotensin II type 1a (AT-1a) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR2-1-E Angiotensin II type 2 (AT-2) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AHR-2-E Aryl hydrocarbon receptor (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AL5AP-1-E 5-lipoxygenase activating protein (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA-2-E Monoamine oxidase A (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ARP19-1-E cyclic AMP phosphoprotein (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BCR-1-E Breakpoint cluster region protein (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BRAF-1-E Serine/threonine-protein kinase B-raf (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
CAC1C-1-E Voltage-gated L-type calcium channel alpha-1C subunit (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D-1-E Voltage-gated L-type calcium channel alpha-1D subunit (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1E-1-E Voltage-gated R-type calcium channel alpha-1E subunit (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1S-1-E Voltage-gated L-type calcium channel alpha-1S subunit (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-1-E Carbonic anhydrase II (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4-1-E Carbonic anhydrase IV (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR1-1-E Cannabinoid CB1 receptor (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1-1-E Dopamine D1 receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4-1-E Dopamine D4 receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERBB4-1-E Receptor protein-tyrosine kinase erbB-4 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FFAR1-1-E Free fatty acid receptor 1 (cluster #1 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
GBRA1-1-E GABA receptor alpha-1 subunit (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1-4-E GABA receptor alpha-1 subunit (cluster #4 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
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
GBRB3-2-E GABA receptor beta-3 subunit (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2-2-E GABA receptor gamma-2 subunit (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRR1-4-E GABA receptor rho-1 subunit (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRR2-2-E GABA receptor rho-2 subunit (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRR2-3-E GABA receptor rho-2 subunit (cluster #3 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
GPR44-1-E G protein-coupled receptor 44 (cluster #1 of 2) 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
GRM1-5-E Metabotropic glutamate receptor 1 (cluster #5 of 5) 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
GRM5-3-E Metabotropic glutamate receptor 5 (cluster #3 of 5) 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
GRM8-2-E Metabotropic glutamate receptor 8 (cluster #2 of 2) 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
HRH1-2-E Histamine H1 receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3-2-E Histamine H3 receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH4-2-E Histamine H4 receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
JAK1-1-E Tyrosine-protein kinase JAK1 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
JAK3-1-E Tyrosine-protein kinase JAK3 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2-1-E HERG (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KIF11-1-E Kinesin-like protein 1 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KIT-1-E Stem cell growth factor receptor (cluster #1 of 1) 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
MDFA-1-B Multidrug translocase mdfA (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MP2K1-2-E Dual specificity mitogen-activated protein kinase kinase 1 (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
NMDZ1-1-E Glutamate (NMDA) receptor subunit zeta 1 (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX4-1-E P2X purinoceptor 4 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX5-1-E P2X purinoceptor 5 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX6-1-E P2X purinoceptor 6 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY2-1-E Purinergic receptor P2Y2 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY4-1-E Pyrimidinergic receptor P2Y4 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2Y11-1-E Purinergic receptor P2Y11 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PD2R-1-E Prostanoid DP receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGFRB-1-E Platelet-derived growth factor receptor beta (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
PPARD-1-E Peroxisome proliferator-activated receptor delta (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72874-1-V Human immunodeficiency virus type 1 protease (cluster #1 of 1) Viruses 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q8JXU8-1-V Hepatitis C virus NS5B RNA-dependent RNA polymerase (cluster #1 of 1) Viruses 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q94F81-2-E Histone deacetylase HD2 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9WTR4-2-E Norepinephrine transporter (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RAF1-2-E Serine/threonine-protein kinase RAF (cluster #2 of 2) 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
TA2R-1-E Thromboxane A2 receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBA1A-1-E Tubulin alpha-1 chain (cluster #1 of 2) 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
TGFR1-1-E TGF-beta receptor type I (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
THAS-1-E Thromboxane-A synthase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
THRB-1-E Thrombin (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TPOR-1-E Thrombopoietin receptor (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
Z100499-2-O SARS coronavirus (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100731-1-O Bcap37 (Breast carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100741-1-O MC9 (Mast cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100741-2-O MC9 (Mast cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101736-1-O Colletotrichum coccodes (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101794-1-O Felid herpesvirus 1 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101821-3-O H2N2 subtype (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101852-1-O Influenza C virus (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
Z101973-1-O Paracentrotus lividus (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102015-1-O Plasmodium vivax (cluster #1 of 1) 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
Z102178-1-O Liver microsomes (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102306-2-O Aorta (cluster #2 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103203-1-O A375 (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103204-2-O A427 (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103205-1-O A431 (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103205-2-O A431 (cluster #2 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
Z103205-4-O A431 (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103348-1-O NCI-H2122 (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103348-2-O NCI-H2122 (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103419-1-O UACC-812 (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104287-1-O Neuronal acetylcholine receptor; alpha3/beta4 (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104297-1-O Glutamate NMDA receptor; GRIN1/GRIN2B (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104298-1-O Glutamate NMDA receptor; GRIN1/GRIN2A (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50136-2-O Plasmodium falciparum (isolate FcB1 / Columbia) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50212-1-O Escherichia coli (cluster #1 of 7) 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
Z50417-1-O Leishmania infantum (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-14-O Plasmodium falciparum (cluster #14 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
Z50425-5-O Plasmodium falciparum (cluster #5 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
Z50425-9-O Plasmodium falciparum (cluster #9 of 22) 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
Z50458-3-O Leishmania braziliensis (cluster #3 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50459-8-O Leishmania donovani (cluster #8 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50460-3-O Leishmania major (cluster #3 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50472-2-O Toxoplasma gondii (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50472-3-O Toxoplasma gondii (cluster #3 of 4) 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
Z50512-4-O Cavia porcellus (cluster #4 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
Z50518-3-O Human herpesvirus 4 (cluster #3 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50523-1-O Influenza B virus (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50525-1-O Tacaribe virus (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
Z50588-6-O Canis familiaris (cluster #6 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50590-1-O Sus scrofa (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50592-8-O Oryctolagus cuniculus (cluster #8 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-6-O Mus musculus (cluster #6 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-8-O Mus musculus (cluster #8 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-11-O Rattus norvegicus (cluster #11 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-2-O Rattus norvegicus (cluster #2 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-3-O Rattus norvegicus (cluster #3 of 12) 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
Z50600-1-O Vaccinia virus (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607-3-O Human immunodeficiency virus 1 (cluster #3 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607-8-O Human immunodeficiency virus 1 (cluster #8 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50611-2-O Moloney murine leukemia virus (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50612-1-O Moloney murine sarcoma virus (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50643-3-O Hepatitis C virus (cluster #3 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50652-4-O Influenza A virus (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50654-1-O Junin virus (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50655-1-O Pichinde virus (cluster #1 of 1) 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
Z50677-3-O Human immunodeficiency virus (cluster #3 of 3) 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
Z80024-2-O A9 (Fibroblast cells) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80035-1-O B16 (Melanoma cells) (cluster #1 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80035-6-O B16 (Melanoma cells) (cluster #6 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80036-1-O BaF3 (IL-3-dependent pro-B-cells) (cluster #1 of 3) 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
Z80054-2-O Caco-2 (Colon adenocarcinoma cells) (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80054-4-O Caco-2 (Colon adenocarcinoma cells) (cluster #4 of 4) 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
Z80067-1-O CCRF-HSB-2 (T-cell leukemia cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80076-2-O CEM-SS (T-cell leukemia) (cluster #2 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80088-4-O CHO (Ovarian cells) (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80100-1-O COLO 320 (Colon adenocarcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80101-1-O COLO 320DM (Colon adenocarcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80101-2-O COLO 320DM (Colon adenocarcinoma cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80109-2-O CTLL (Cytotoxic T-cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80118-1-O Detroit 551 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80120-3-O DLD-1 (Colon adenocarcinoma cells) (cluster #3 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80125-1-O DU-145 (Prostate carcinoma) (cluster #1 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80125-6-O DU-145 (Prostate carcinoma) (cluster #6 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80132-2-O EL4 (Thymoma cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80136-3-O FM3A (Breast carcinoma cells) (cluster #3 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80141-1-O GH3 (Pituitary adenoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80145-1-O H69 (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-12-O HL-60 (Promyeloblast leukemia cells) (cluster #12 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-8-O HL-60 (Promyeloblast leukemia cells) (cluster #8 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-9-O HL-60 (Promyeloblast leukemia cells) (cluster #9 of 12) 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
Z80166-2-O HT-29 (Colon adenocarcinoma cells) (cluster #2 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-8-O HT-29 (Colon adenocarcinoma cells) (cluster #8 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-7-O K562 (Erythroleukemia cells) (cluster #7 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-9-O K562 (Erythroleukemia cells) (cluster #9 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80192-2-O KM12 (Colon adenocarcinoma cells) (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193-8-O L1210 (Lymphocytic leukemia cells) (cluster #8 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80208-1-O L5178Y (Lymphoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80211-5-O LoVo (Colon adenocarcinoma cells) (cluster #5 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-2-O MCF7 (Breast carcinoma cells) (cluster #2 of 14) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-6-O MCF7 (Breast carcinoma cells) (cluster #6 of 14) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80227-1-O MCF7-ADR (Breast carcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80231-2-O MCF7S (Breast carcinoma cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80244-1-O MDA-MB-468 (Breast adenocarcinoma) (cluster #1 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80262-1-O NCI-H1975 (Bronchoalveolar carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80268-1-O MKN-28 (Gastric epithelial carcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80269-1-O MKN-45 (Gastric adenocarcinoma cells) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80269-3-O MKN-45 (Gastric adenocarcinoma cells) (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80285-1-O MOLT-4 (Acute T-lymphoblastic leukemia cells) (cluster #1 of 4) 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
Z80294-1-O MT2 (Lymphocytes) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80295-4-O MT4 (Lymphocytes) (cluster #4 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80295-6-O MT4 (Lymphocytes) (cluster #6 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80295-7-O MT4 (Lymphocytes) (cluster #7 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80296-1-O MVLN (cluster #1 of 1) 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
Z80334-1-O NG108-15 (Neuroblastoma-glioma hybrid cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80347-2-O NUGC-3 (Gastric carcinoma cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80362-1-O P388 (Lymphoma cells) (cluster #1 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80362-5-O P388 (Lymphoma cells) (cluster #5 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80364-1-O P388/ADR (Lymphoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80390-6-O PC-3 (Prostate carcinoma cells) (cluster #6 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80414-1-O Raji (B-lymphoblastic cells) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80418-9-O RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #9 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80419-1-O RBL-1 (Basophilic leukemia cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80427-1-O RKO (Colon carcinoma) (cluster #1 of 1) 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
Z80466-2-O SF268 (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80482-4-O SK-MEL-2 (Melanoma cells) (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80485-4-O SK-MEL-28 (Melanoma cells) (cluster #4 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80485-5-O SK-MEL-28 (Melanoma cells) (cluster #5 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80490-4-O SK-MES-1 (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80493-3-O SK-OV-3 (Ovarian carcinoma cells) (cluster #3 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
Z80513-1-O SQ20B (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80514-1-O St-4 (Stomach carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80525-2-O SW48 (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80526-3-O SW480 (Colon adenocarcinoma cells) (cluster #3 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80532-1-O T-24 (Bladder carcinoma cells) (cluster #1 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80532-5-O T-24 (Bladder carcinoma cells) (cluster #5 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80552-1-O TLX-5 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80583-3-O Vero (Kidney cells) (cluster #3 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80583-6-O Vero (Kidney cells) (cluster #6 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80589-2-O WI-38 (Embryonic lung fibroblast cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80608-4-O ZR-75-1 (Breast carcinoma cells) (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80653-2-O 9L (Glioma cells) (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
Z80682-2-O A549 (Lung carcinoma cells) (cluster #2 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682-8-O A549 (Lung carcinoma cells) (cluster #8 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80686-1-O AZ-521 cell line (cluster #1 of 1) 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
Z80712-5-O T47D (Breast carcinoma cells) (cluster #5 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80712-6-O T47D (Breast carcinoma cells) (cluster #6 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80742-2-O C6 (Glioma cells) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80768-1-O CH1 (Ovarian carcinoma cells) (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
Z80838-1-O EOL1 (Eosinophilic cells) (cluster #1 of 1) 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
Z80852-3-O A-431 (Epidermoid carcinoma cells) (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80857-1-O Friend leukemia cell line (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80862-1-O GC3/MTK- cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80870-2-O GM892A cell line (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80874-1-O CEM (T-cell leukemia) (cluster #1 of 7) 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
Z80874-5-O CEM (T-cell leukemia) (cluster #5 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80896-1-O NCI-H69 (Small cell lung carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80901-1-O HaCaT (Keratinocytes) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80902-1-O HASMC (Aortic smooth muscle cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80928-1-O HCT-116 (Colon carcinoma cells) (cluster #1 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80928-7-O HCT-116 (Colon carcinoma cells) (cluster #7 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80942-1-O HEL (Embryonic lung cells) (cluster #1 of 2) 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
Z80951-2-O NIH3T3 (Fibroblasts) (cluster #2 of 4) 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
Z80954-2-O HFF (Foreskin fibroblasts) (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81017-1-O WiDr (Colon adenocarcinoma cells) (cluster #1 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81020-3-O HepG2 (Hepatoblastoma cells) (cluster #3 of 8) 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
Z81024-1-O NCI-H460 (Non-small cell lung carcinoma) (cluster #1 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81024-2-O NCI-H460 (Non-small cell lung carcinoma) (cluster #2 of 8) 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
Z81024-6-O NCI-H460 (Non-small cell lung carcinoma) (cluster #6 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81034-5-O A2780 (Ovarian carcinoma cells) (cluster #5 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81041-1-O Prostatic carcinoma cells (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81043-2-O N592 (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81048-1-O TSU (Prostatic carcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81054-2-O SF-268 (Glioblastoma cells) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81068-1-O Ishikawa (Uterine carcinoma cells) (cluster #1 of 1) 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
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
Z81115-3-O KB (Squamous cell carcinoma) (cluster #3 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81115-6-O KB (Squamous cell carcinoma) (cluster #6 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81121-1-O KKLS cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81135-2-O L6 (Skeletal muscle myoblast cells) (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81135-4-O L6 (Skeletal muscle myoblast cells) (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81138-1-O ScN2a (Scrapie-infected neuroblastoma cells) (cluster #1 of 3) 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
Z81170-3-O LNCaP (Prostate carcinoma) (cluster #3 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81170-4-O LNCaP (Prostate carcinoma) (cluster #4 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81184-5-O LOX IMVI (Melanoma cells) (cluster #5 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81187-1-O LT12 tumor cell line (cluster #1 of 1) 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
Z81217-1-O LY3.7.2C TK-/- cell lines (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
Z81245-1-O MDA-MB-435 (Breast carcinoma cells) (cluster #1 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81245-4-O MDA-MB-435 (Breast carcinoma cells) (cluster #4 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-5-O HeLa (Cervical adenocarcinoma cells) (cluster #5 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-6-O HeLa (Cervical adenocarcinoma cells) (cluster #6 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81277-1-O NCI-N417 (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81280-3-O NCI-H226 (Non-small cell lung carcinoma cells) (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81281-1-O NCI-H23 (Non-small cell lung carcinoma cells) (cluster #1 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81281-4-O NCI-H23 (Non-small cell lung carcinoma cells) (cluster #4 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81283-1-O NCI-H522 (Non-small cell lung carcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81330-1-O SNU- (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81331-3-O SW-620 (Colon adenocarcinoma cells) (cluster #3 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81335-1-O HCT-15 (Colon adenocarcinoma cells) (cluster #1 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81335-2-O HCT-15 (Colon adenocarcinoma cells) (cluster #2 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81335-3-O HCT-15 (Colon adenocarcinoma cells) (cluster #3 of 5) 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