UCSF

BOC Sciences BB

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

Functional 10μM Targets with Highest Number of Available Compounds (864 in total)

Name (Code) Description Organism Class Size Browse Download (Annotations)
Z50425-3-O Plasmodium falciparum (cluster #3 of 22) Other 75 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-1-O Rattus norvegicus (cluster #1 of 12) Other 42 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-1-O MCF7 (Breast carcinoma cells) (cluster #1 of 14) Other 28 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-11-O Plasmodium falciparum (cluster #11 of 22) Other 25 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50512-1-O Cavia porcellus (cluster #1 of 7) Other 21 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-1-O Mus musculus (cluster #1 of 9) Other 16 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-12-O Rattus norvegicus (cluster #12 of 12) Other 16 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607-1-O Human immunodeficiency virus 1 (cluster #1 of 10) Other 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50587-1-O Homo sapiens (cluster #1 of 9) Other 14 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193-2-O L1210 (Lymphocytic leukemia cells) (cluster #2 of 12) Other 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4-1-E Serotonin transporter (cluster #1 of 1) Eukaryotes 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-1-E Dopamine D2 receptor (cluster #1 of 1) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2-1-E HERG (cluster #1 of 2) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50466-1-O Trypanosoma cruzi (cluster #1 of 8) Other 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50592-3-O Oryctolagus cuniculus (cluster #3 of 8) Other 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682-1-O A549 (Lung carcinoma cells) (cluster #1 of 11) Other 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C-1-E 5-hydroxytryptamine receptor 2C (cluster #1 of 2) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9WTR4-1-E Norepinephrine transporter (cluster #1 of 2) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
TAAR1-2-E Trace amine-associated receptor 1 (cluster #2 of 2) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302-1-O Glutamate NMDA receptor (cluster #1 of 3) Other 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-1-O Plasmodium falciparum (cluster #1 of 22) Other 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50606-1-O Hepatitis B virus (cluster #1 of 3) Other 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50677-1-O Human immunodeficiency virus (cluster #1 of 3) Other 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-1-O HT-29 (Colon adenocarcinoma cells) (cluster #1 of 12) Other 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81115-2-O KB (Squamous cell carcinoma) (cluster #2 of 6) Other 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-1-O HeLa (Cervical adenocarcinoma cells) (cluster #1 of 9) Other 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2-1-E Beta-2 adrenergic receptor (cluster #1 of 2) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-15-O Plasmodium falciparum (cluster #15 of 22) Other 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50587-4-O Homo sapiens (cluster #4 of 9) Other 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-1-O HL-60 (Promyeloblast leukemia cells) (cluster #1 of 12) Other 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81057-1-O HUVEC (Umbilical vein endothelial cells) (cluster #1 of 4) Other 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B-1-E Serotonin 2b (5-HT2b) receptor (cluster #1 of 2) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3-1-E Dopamine transporter (cluster #1 of 1) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-2-O Rattus norvegicus (cluster #2 of 12) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80125-1-O DU-145 (Prostate carcinoma) (cluster #1 of 9) 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
Z81252-3-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #3 of 11) Other 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A-2-E Serotonin 2a (5-HT2a) receptor (cluster #2 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1-1-E Dopamine D1 receptor (cluster #1 of 1) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2-1-E Estrogen receptor beta (cluster #1 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE2-1-E Glutamate [NMDA] receptor subunit epsilon 2 (cluster #1 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-2-O Plasmodium falciparum (cluster #2 of 22) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50530-1-O Human herpesvirus 5 (cluster #1 of 5) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50587-3-O Homo sapiens (cluster #3 of 9) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50592-1-O Oryctolagus cuniculus (cluster #1 of 8) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-6-O Mus musculus (cluster #6 of 9) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50602-2-O Human herpesvirus 1 (cluster #2 of 5) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607-4-O Human immunodeficiency virus 1 (cluster #4 of 10) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80064-1-O CCRF-CEM (T-cell leukemia) (cluster #1 of 9) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80136-1-O FM3A (Breast carcinoma cells) (cluster #1 of 6) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-2-O HL-60 (Promyeloblast leukemia cells) (cluster #2 of 12) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80390-1-O PC-3 (Prostate carcinoma cells) (cluster #1 of 10) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81024-1-O NCI-H460 (Non-small cell lung carcinoma) (cluster #1 of 8) Other 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1-1-E Beta-1 adrenergic receptor (cluster #1 of 1) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3-1-E Dopamine D3 receptor (cluster #1 of 1) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR1-1-E P-glycoprotein 1 (cluster #1 of 2) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1-2-E Glutamate (NMDA) receptor subunit zeta 1 (cluster #2 of 3) 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
Z50425-4-O Plasmodium falciparum (cluster #4 of 22) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-6-O Rattus norvegicus (cluster #6 of 12) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-7-O Rattus norvegicus (cluster #7 of 12) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80164-1-O HT-1080 (Fibrosarcoma cells) (cluster #1 of 6) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80390-3-O PC-3 (Prostate carcinoma cells) (cluster #3 of 10) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80485-1-O SK-MEL-28 (Melanoma cells) (cluster #1 of 6) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80954-1-O HFF (Foreskin fibroblasts) (cluster #1 of 4) 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
Z81252-6-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #6 of 11) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D-1-E Serotonin 1d (5-HT1d) receptor (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2BR-1-E Adenosine A2b receptor (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A-1-E Alpha-1a adrenergic receptor (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D-1-E Alpha-1d adrenergic receptor (cluster #1 of 4) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3-1-E Beta-3 adrenergic receptor (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C-1-E Voltage-gated L-type calcium channel alpha-1C subunit (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D-1-E Voltage-gated L-type calcium channel alpha-1D subunit (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-1-E Carbonic anhydrase II (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4-1-E Carbonic anhydrase IV (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4-1-E Dopamine D4 receptor (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD5-1-E Dopamine D5 receptor (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR-1-E Epidermal growth factor receptor erbB1 (cluster #1 of 2) 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
ESR1-1-E Estrogen receptor alpha (cluster #1 of 3) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA1-3-E Glutamate receptor ionotropic, AMPA 1 (cluster #3 of 3) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA2-3-E Glutamate receptor ionotropic, AMPA 2 (cluster #3 of 4) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA3-2-E Glutamate receptor ionotropic, AMPA 3 (cluster #2 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM1-4-E Metabotropic glutamate receptor 1 (cluster #4 of 5) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM6-1-E Metabotropic glutamate receptor 6 (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH2-1-E Histamine H2 receptor (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR3-1-E P-glycoprotein 3 (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY6-1-E Pyrimidinergic receptor P2Y6 (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
Z104297-1-O Glutamate NMDA receptor; GRIN1/GRIN2B (cluster #1 of 1) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50472-1-O Toxoplasma gondii (cluster #1 of 4) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80120-1-O DLD-1 (Colon adenocarcinoma cells) (cluster #1 of 5) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80295-2-O MT4 (Lymphocytes) (cluster #2 of 8) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80362-1-O P388 (Lymphoma cells) (cluster #1 of 8) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80409-1-O R2 (cluster #1 of 1) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682-2-O A549 (Lung carcinoma cells) (cluster #2 of 11) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80874-1-O CEM (T-cell leukemia) (cluster #1 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
Z80951-1-O NIH3T3 (Fibroblasts) (cluster #1 of 4) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81138-1-O ScN2a (Scrapie-infected neuroblastoma cells) (cluster #1 of 3) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81170-1-O LNCaP (Prostate carcinoma) (cluster #1 of 5) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-2-O HeLa (Cervical adenocarcinoma cells) (cluster #2 of 9) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES-1-E Acetylcholinesterase (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1-1-E Muscarinic acetylcholine receptor M1 (cluster #1 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1B-1-E Voltage-gated N-type calcium channel alpha-1B subunit (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1S-1-E Voltage-gated L-type calcium channel alpha-1S subunit (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR2-1-E Cannabinoid CB2 receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CXCR1-1-E Interleukin-8 receptor A (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CXCR2-1-E C-X-C chemokine receptor type 2 (cluster #1 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1-2-E Estrogen receptor alpha (cluster #2 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GPBAR-2-E G-protein coupled bile acid receptor 1 (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GPR44-1-E G protein-coupled receptor 44 (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA4-2-E Glutamate receptor ionotropic, AMPA 4 (cluster #2 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM2-1-E Metabotropic glutamate receptor 2 (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM4-1-E Metabotropic glutamate receptor 4 (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1-1-E Histamine H1 receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5-6-E Arachidonate 5-lipoxygenase (cluster #6 of 7) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM-1-E Mu opioid receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY2-1-E Purinergic receptor P2Y2 (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARA-1-E Peroxisome proliferator-activated receptor alpha (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG-1-E Peroxisome proliferator-activated receptor gamma (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72547-1-V Human immunodeficiency virus type 1 reverse transcriptase (cluster #1 of 1) Viruses 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9BEG3-1-E Arachidonate 5-lipoxygenase (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB1-1-E Tubulin beta-1 chain (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100274-1-O Liposome (cluster #1 of 1) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100498-2-O Hepatocytes (cluster #2 of 2) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100741-2-O MC9 (Mast cells) (cluster #2 of 2) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100751-1-O PMNL (Polymorphonuclear leukocytes) (cluster #1 of 2) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102015-1-O Plasmodium vivax (cluster #1 of 1) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50038-1-O Plasmodium yoelii yoelii (cluster #1 of 2) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50136-2-O Plasmodium falciparum (isolate FcB1 / Columbia) (cluster #2 of 3) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50416-1-O Aspergillus fumigatus (cluster #1 of 3) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-12-O Plasmodium falciparum (cluster #12 of 22) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-6-O Plasmodium falciparum (cluster #6 of 22) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-7-O Plasmodium falciparum (cluster #7 of 22) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-9-O Plasmodium falciparum (cluster #9 of 22) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50426-9-O Plasmodium falciparum (isolate K1 / Thailand) (cluster #9 of 9) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50460-3-O Leishmania major (cluster #3 of 4) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50466-4-O Trypanosoma cruzi (cluster #4 of 8) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50468-2-O Giardia intestinalis (cluster #2 of 4) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50473-4-O Plasmodium berghei (cluster #4 of 5) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50515-2-O Human herpesvirus 2 (cluster #2 of 2) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50518-3-O Human herpesvirus 4 (cluster #3 of 5) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50523-1-O Influenza B virus (cluster #1 of 1) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50527-3-O Human herpesvirus 3 (cluster #3 of 3) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-8-O Mus musculus (cluster #8 of 9) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-10-O Rattus norvegicus (cluster #10 of 12) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50643-2-O Hepatitis C virus (cluster #2 of 5) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50652-1-O Influenza A virus (cluster #1 of 4) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-4-O HT-29 (Colon adenocarcinoma cells) (cluster #4 of 12) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80175-1-O IMR-32 (Neuroblastoma cells) (cluster #1 of 2) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-2-O K562 (Erythroleukemia cells) (cluster #2 of 11) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193-7-O L1210 (Lymphocytic leukemia cells) (cluster #7 of 12) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80211-1-O LoVo (Colon adenocarcinoma cells) (cluster #1 of 5) 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
Z80269-1-O MKN-45 (Gastric adenocarcinoma cells) (cluster #1 of 3) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80291-2-O MRC5 (Embryonic lung fibroblast cells) (cluster #2 of 3) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80418-9-O RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #9 of 9) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80493-1-O SK-OV-3 (Ovarian carcinoma cells) (cluster #1 of 6) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80532-1-O T-24 (Bladder carcinoma cells) (cluster #1 of 6) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682-11-O A549 (Lung carcinoma cells) (cluster #11 of 11) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80712-2-O T47D (Breast carcinoma cells) (cluster #2 of 7) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80847-1-O FaDu (Pharyngeal carcinoma cells) (cluster #1 of 3) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80874-7-O CEM (T-cell leukemia) (cluster #7 of 7) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80928-3-O HCT-116 (Colon carcinoma cells) (cluster #3 of 9) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80936-1-O HEK293 (Embryonic kidney fibroblasts) (cluster #1 of 4) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81072-6-O Jurkat (Acute leukemic T-cells) (cluster #6 of 10) 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
Z81331-1-O SW-620 (Colon adenocarcinoma cells) (cluster #1 of 6) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81335-1-O HCT-15 (Colon adenocarcinoma cells) (cluster #1 of 5) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81335-2-O HCT-15 (Colon adenocarcinoma cells) (cluster #2 of 5) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A-1-E Serotonin 1a (5-HT1a) receptor (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B-1-E Serotonin 1b (5-HT1b) receptor (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F-1-E Serotonin 1f (5-HT1f) receptor (cluster #1 of 1) Eukaryotes 2 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
5HT3A-1-E Serotonin 3a (5-HT3a) receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R-1-E Adenosine A1 receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7-3-E Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #3 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY1-1-E Brain adenylate cyclase 1 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2-1-E Adenylate cyclase type II (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY8-1-E Adenylate cyclase type VIII (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1-1-E Angiotensin II type 1a (AT-1a) receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR2-1-E Angiotensin II type 2 (AT-2) receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRB-1-E Angiotensin II type 1b (AT-1b) receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR-2-E Androgen Receptor (cluster #2 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR-3-E Androgen Receptor (cluster #3 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4A-1-E Potassium-transporting ATPase alpha chain 1 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4B-1-E Potassium-transporting ATPase beta chain (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-1-E Carbonic anhydrase I (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLTR1-1-E Cysteinyl leukotriene receptor 1 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CRFR1-1-E Corticotropin releasing factor receptor 1 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
EDNRB-1-E Endothelin receptor ET-B (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRR1-1-E GABA receptor rho-1 subunit (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRR1-4-E GABA receptor rho-1 subunit (cluster #4 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM3-1-E Metabotropic glutamate receptor 3 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM5-5-E Metabotropic glutamate receptor 5 (cluster #5 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM6-2-E Metabotropic glutamate receptor 6 (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM8-1-E Metabotropic glutamate receptor 8 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM8-2-E Metabotropic glutamate receptor 8 (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3-2-E Histamine H3 receptor (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH4-2-E Histamine H4 receptor (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRP1-1-E Histidine-rich protein (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LKHA4-1-E Leukotriene A4 hydrolase (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5-2-E Arachidonate 5-lipoxygenase (cluster #2 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE1-1-E Glutamate [NMDA] receptor subunit epsilon 1 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE3-1-E Glutamate [NMDA] receptor subunit epsilon 3 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE3-2-E Glutamate [NMDA] receptor subunit epsilon 3 (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD-1-E Delta opioid receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM-2-E Mu opioid receptor (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX1-1-E P2X purinoceptor 1 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY4-1-E Pyrimidinergic receptor P2Y4 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P97706-1-E Sodium channel protein type VI alpha subunit (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1-1-E Cyclooxygenase-1 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q8JXU8-1-V Hepatitis C virus NS5B RNA-dependent RNA polymerase (cluster #1 of 1) Viruses 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
SC6A2-2-E Norepinephrine transporter (cluster #2 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN5A-1-E Sodium channel protein type V alpha subunit (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TA2R-1-E Thromboxane A2 receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB2B-1-E Tubulin beta chain (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
THRB-1-E Thrombin (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPA1-5-E Transient receptor potential cation channel subfamily A member 1 (cluster #5 of 6) 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
Z100275-1-O Hemozoin (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100516-1-O Hs 683 (Glioma cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100766-1-O Radical scavenging activity (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101682-1-O BK polyomavirus (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101767-1-O Dengue virus 2 (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101794-1-O Felid herpesvirus 1 (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101821-1-O H2N2 subtype (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101822-1-O H3N2 subtype (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101849-2-O Human papillomavirus type 16 (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101865-1-O Leishmania chagasi (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102013-2-O Plasmodium malariae (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
Z102121-2-O Trichophyton mentagrophytes (cluster #2 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102306-1-O Aorta (cluster #1 of 6) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103205-1-O A431 (cluster #1 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103205-3-O A431 (cluster #3 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104283-1-O Neuronal acetylcholine receptor; alpha4/beta2 (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301-1-O GABA-A receptor; anion channel (cluster #1 of 2) 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
Z50046-1-O Trichophyton quinckeanum (cluster #1 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
Z50339-1-O Pneumocystis carinii (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50362-1-O Lactobacillus casei (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50380-1-O Mycobacterium smegmatis (cluster #1 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50380-2-O Mycobacterium smegmatis (cluster #2 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50408-1-O Issatchenkia orientalis (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50409-1-O Kluyveromyces marxianus (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50420-1-O Trypanosoma brucei brucei (cluster #1 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50424-1-O Cryptosporidium parvum (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50424-2-O Cryptosporidium parvum (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-5-O Plasmodium falciparum (cluster #5 of 22) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50426-6-O Plasmodium falciparum (isolate K1 / Thailand) (cluster #6 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50442-1-O Candida albicans (cluster #1 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50443-1-O Candida glabrata (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50452-1-O Trichophyton rubrum (cluster #1 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
Z50459-2-O Leishmania donovani (cluster #2 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50466-2-O Trypanosoma cruzi (cluster #2 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50472-3-O Toxoplasma gondii (cluster #3 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50474-1-O Plasmodium yoelii (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50512-3-O Cavia porcellus (cluster #3 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50512-6-O Cavia porcellus (cluster #6 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50517-1-O Human herpesvirus 5 strain AD169 (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50588-6-O Canis familiaris (cluster #6 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50590-1-O Sus scrofa (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50592-5-O Oryctolagus cuniculus (cluster #5 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-2-O Mus musculus (cluster #2 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607-3-O Human immunodeficiency virus 1 (cluster #3 of 10) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607-5-O Human immunodeficiency virus 1 (cluster #5 of 10) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50658-1-O Human immunodeficiency virus 2 (cluster #1 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50658-2-O Human immunodeficiency virus 2 (cluster #2 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50665-1-O Enterovirus (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50725-1-O Trypanosoma brucei rhodesiense (cluster #1 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50725-6-O Trypanosoma brucei rhodesiense (cluster #6 of 7) 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
Z80025-1-O ACHN (Renal adenocarcinoma cells) (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80064-3-O CCRF-CEM (T-cell leukemia) (cluster #3 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80099-1-O COLO 205 (Colon adenocarcinoma cells) (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80106-1-O COS-1 (Kidney cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80133-1-O EMT6 (Mammary carcinoma cells) (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-8-O HL-60 (Promyeloblast leukemia cells) (cluster #8 of 12) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-9-O HL-60 (Promyeloblast leukemia cells) (cluster #9 of 12) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-12-O HT-29 (Colon adenocarcinoma cells) (cluster #12 of 12) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80211-2-O LoVo (Colon adenocarcinoma cells) (cluster #2 of 5) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-2-O MCF7 (Breast carcinoma cells) (cluster #2 of 14) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-6-O MCF7 (Breast carcinoma cells) (cluster #6 of 14) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80227-1-O MCF7-ADR (Breast carcinoma cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80285-2-O MOLT-4 (Acute T-lymphoblastic leukemia cells) (cluster #2 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80294-1-O MT2 (Lymphocytes) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80295-4-O MT4 (Lymphocytes) (cluster #4 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80295-7-O MT4 (Lymphocytes) (cluster #7 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80334-1-O NG108-15 (Neuroblastoma-glioma hybrid cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80347-2-O NUGC-3 (Gastric carcinoma cells) (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80354-1-O OVCAR-3 (Ovarian adenocarcinoma cells) (cluster #1 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80362-8-O P388 (Lymphoma cells) (cluster #8 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80414-1-O Raji (B-lymphoblastic cells) (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80418-2-O RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #2 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80418-4-O RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #4 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80419-1-O RBL-1 (Basophilic leukemia cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80466-1-O SF268 (cluster #1 of 4) 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
Z80525-2-O SW48 (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80539-1-O T98G (Glioblastoma cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80548-2-O THP-1 (Acute monocytic leukemia cells) (cluster #2 of 5) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80563-1-O U-373 MG ( Glioblastoma cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80565-1-O U-87 MG (Glioblastoma cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80566-1-O U-937 (Histiocytic lymphoma cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80583-4-O Vero (Kidney cells) (cluster #4 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80583-7-O Vero (Kidney cells) (cluster #7 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80640-1-O 786-0 (Renal carcinoma cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80653-2-O 9L (Glioma cells) (cluster #2 of 2) 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
Z80686-1-O AZ-521 cell line (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80697-1-O Bel-7402 (Hepatoma cells) (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80711-1-O NCI/ADR-RES (Breast carcinoma cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80712-6-O T47D (Breast carcinoma cells) (cluster #6 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80742-1-O C6 (Glioma cells) (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80897-1-O H9 (T-lymphoid cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80942-1-O HEL (Embryonic lung cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80954-2-O HFF (Foreskin fibroblasts) (cluster #2 of 4) 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
Z81011-1-O human cell lines (cluster #1 of 3) 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
Z81020-7-O HepG2 (Hepatoblastoma cells) (cluster #7 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81024-5-O NCI-H460 (Non-small cell lung carcinoma) (cluster #5 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81065-1-O IGROV-1 (Ovarian adenocarcinoma cells) (cluster #1 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81068-1-O Ishikawa (Uterine carcinoma cells) (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81072-1-O Jurkat (Acute leukemic T-cells) (cluster #1 of 10) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81074-1-O K177cell line (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81121-1-O KKLS cell line (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81135-4-O L6 (Skeletal muscle myoblast cells) (cluster #4 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81245-1-O MDA-MB-435 (Breast carcinoma cells) (cluster #1 of 6) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-5-O HeLa (Cervical adenocarcinoma cells) (cluster #5 of 9) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-7-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #7 of 11) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81281-1-O NCI-H23 (Non-small cell lung carcinoma cells) (cluster #1 of 5) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81283-1-O NCI-H522 (Non-small cell lung carcinoma cells) (cluster #1 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81330-1-O SNU- (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81335-3-O HCT-15 (Colon adenocarcinoma cells) (cluster #3 of 5) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A-2-E Serotonin 1a (5-HT1a) receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B-2-E Serotonin 1b (5-HT1b) receptor (cluster #2 of 2) 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
5HT3C-1-E Serotonin 3c (5-HT3c) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3D-1-E Serotonin 3d (5-HT3d) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3E-1-E Serotonin 3e (5-HT3e) 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
5HT6R-1-E 5-hydroxytryptamine receptor 6 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R-1-E Serotonin 7 (5-HT7) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR-1-E Adenosine A2a receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R-1-E Adenosine A3 receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL1-2-E Tyrosine-protein kinase ABL (cluster #2 of 2) 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
ACHA3-2-E Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4-2-E Neuronal acetylcholine receptor protein alpha-4 subunit (cluster #2 of 2) 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
ACHD-1-E Acetylcholine receptor protein delta chain (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1-2-E Muscarinic acetylcholine receptor M1 (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2-2-E Muscarinic acetylcholine receptor M2 (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
ACM5-2-E Muscarinic acetylcholine receptor M5 (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA17-1-E ADAM17 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A-2-E Alpha-1a adrenergic receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B-1-E Alpha-1b adrenergic receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A-3-E Alpha-2a adrenergic receptor (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B-2-E Alpha-2b adrenergic receptor (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B-3-E Alpha-2b adrenergic receptor (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C-3-E Alpha-2c adrenergic receptor (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADK-1-E Adenosine kinase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRA-1-E Angiotensin II type 1a (AT-1a) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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-2-E Breakpoint cluster region protein (cluster #2 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
CAC1E-1-E Voltage-gated R-type calcium channel alpha-1E subunit (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1G-1-E Voltage-gated T-type calcium channel alpha-1G subunit (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1H-1-E Voltage-gated T-type calcium channel alpha-1H subunit (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-2-E Carbonic anhydrase I (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-3-E Carbonic anhydrase I (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9-1-E Carbonic anhydrase IX (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCKAR-1-E Cholecystokinin A receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLTR2-1-E Cysteinyl leukotriene receptor 2 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR1-1-E Cannabinoid CB1 receptor (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CXCR4-1-E C-X-C chemokine receptor type 4 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR-1-B Dihydrofolate reductase (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EDNRA-1-E Endothelin receptor ET-A (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR-2-E Epidermal growth factor receptor erbB1 (cluster #2 of 2) 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
FNTA-1-E Protein farnesyltransferase/geranylgeranyltransferase type I alpha subunit (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FNTB-1-E Protein farnesyltransferase beta subunit (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
GBRA1-4-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
GBRB3-2-E GABA receptor beta-3 subunit (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2-1-E GABA receptor gamma-2 subunit (cluster #1 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
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
GRIA1-2-E Glutamate receptor ionotropic, AMPA 1 (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA2-2-E Glutamate receptor ionotropic, AMPA 2 (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIK1-2-E Glutamate receptor ionotropic kainate 1 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIK2-2-E Glutamate receptor ionotropic kainate 2 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIK3-1-E Glutamate receptor ionotropic kainate 3 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIK4-1-E Glutamate receptor ionotropic kainate 4 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIK5-1-E Glutamate receptor ionotropic kainate 5 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM1-5-E Metabotropic glutamate receptor 1 (cluster #5 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM5-3-E Metabotropic glutamate receptor 5 (cluster #3 of 5) 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
ITA2B-2-E Integrin alpha-IIb (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ITB3-1-E Integrin beta-3 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNQ2-1-E Voltage-gated potassium channel subunit Kv7.2 (cluster #1 of 1) 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
LOX5-4-E Arachidonate 5-lipoxygenase (cluster #4 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LT4R1-1-E Leukotriene B4 receptor 1 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LT4R2-1-E Leukotriene B4 receptor 2 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MCR-2-E Mineralocorticoid receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR1-2-E P-glycoprotein 1 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR3-2-E P-glycoprotein 3 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MP2K1-2-E Dual specificity mitogen-activated protein kinase kinase 1 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NK1R-1-E Neurokinin 1 receptor (cluster #1 of 1) 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
NOS1-2-E Nitric-oxide synthase, brain (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2-1-E Nitric oxide synthase, inducible (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS3-1-E Nitric-oxide synthase, endothelial (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NR1H4-2-E Bile acid receptor FXR (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NRAM-1-V Neuraminidase (cluster #1 of 1) Viruses 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NTR1-1-E Neurotensin receptor 1 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
O77823-1-E Phosphodiesterase 4A (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRK-1-E Kappa opioid receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY1-1-E P2Y purinoceptor 1 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2Y12-1-E Purinergic receptor P2Y12 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2Y14-1-E P2Y purinoceptor 14 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE1A-1-E Phosphodiesterase 1A (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE1B-1-E Phosphodiesterase 1B (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE1C-1-E Phosphodiesterase 1C (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE5A-1-E Phosphodiesterase 5A (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGFRA-1-E Platelet-derived growth factor receptor alpha (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
PRGR-1-E Progesterone receptor (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
PTAFR-1-E Platelet activating factor receptor (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PUR2-1-E GAR transformylase (cluster #1 of 1) 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
Q864F1-1-E Phosphodiesterase 5 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q8X6S1-1-B Modulator of drug activity A (cluster #1 of 1) Bacteria 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
S6A11-1-E GABA transporter 3 (cluster #1 of 2) 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
S6A13-1-E GABA transporter 2 (cluster #1 of 2) 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
SCN1A-2-E Sodium channel protein type I alpha subunit (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN2A-2-E Sodium channel protein type II alpha subunit (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN2A-3-E Sodium channel protein type II alpha subunit (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN3A-2-E Sodium channel protein type III alpha subunit (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SL9A1-1-E Sodium/hydrogen exchanger 1 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TAAR1-1-E Trace amine-associated receptor 1 (cluster #1 of 2) 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
TBB2B-2-E Tubulin beta chain (cluster #2 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
TBB3-3-E Tubulin beta-3 chain (cluster #3 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
TBB4A-3-E Tubulin beta-4 chain (cluster #3 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
TBB4B-3-E Tubulin beta-2 chain (cluster #3 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
TBB8-3-E Tubulin beta-8 chain (cluster #3 of 3) 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
TLR2-1-E Toll-like receptor 2 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TNFA-2-E TNF-alpha (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPM8-1-E Transient receptor potential cation channel subfamily M member 8 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPV1-1-E Vanilloid receptor (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
VGFR1-1-E Vascular endothelial growth factor receptor 1 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR2-1-E Vascular endothelial growth factor receptor 2 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR3-1-E Vascular endothelial growth factor receptor 3 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100081-3-O PBMC (Peripheral blood mononuclear cells) (cluster #3 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100081-4-O PBMC (Peripheral blood mononuclear cells) (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100405-1-O MV4-11 (Myeloid leukemia cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100492-1-O MCF10 (Normal breast epithelial cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100499-1-O SARS coronavirus (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100704-1-O Lactuca sativa (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100731-1-O Bcap37 (Breast carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101736-1-O Colletotrichum coccodes (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101821-3-O H2N2 subtype (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101829-1-O HBV genotype D (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101852-1-O Influenza C virus (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101870-2-O Leishmania guyanensis (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101973-1-O Paracentrotus lividus (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
Z102121-1-O Trichophyton mentagrophytes (cluster #1 of 3) 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
Z102213-1-O Blood (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102222-1-O Plasma (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102306-2-O Aorta (cluster #2 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102317-1-O Brain (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102352-1-O Plasma (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103203-1-O A375 (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103204-1-O A427 (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103204-2-O A427 (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103205-2-O A431 (cluster #2 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
Z103216-1-O C32 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103267-1-O H4 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103348-1-O NCI-H2122 (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103348-2-O NCI-H2122 (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
Z104288-1-O Neuronal acetylcholine receptor; alpha3/beta4 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104290-1-O Neuronal acetylcholine receptor; alpha4/beta2 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50076-1-O Poliovirus (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50212-1-O Escherichia coli (cluster #1 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50212-2-O Escherichia coli (cluster #2 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50266-1-O Enterococcus faecium (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50324-2-O Arabidopsis thaliana (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50335-1-O Oryza sativa (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50380-3-O Mycobacterium smegmatis (cluster #3 of 4) 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
Z50417-1-O Leishmania infantum (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50418-2-O Trypanosoma brucei (cluster #2 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50418-5-O Trypanosoma brucei (cluster #5 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50422-3-O Entamoeba histolytica (cluster #3 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50422-5-O Entamoeba histolytica (cluster #5 of 5) 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
Z50425-17-O Plasmodium falciparum (cluster #17 of 22) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50425-21-O Plasmodium falciparum (cluster #21 of 22) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50426-1-O Plasmodium falciparum (isolate K1 / Thailand) (cluster #1 of 9) 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
Z50442-2-O Candida albicans (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50442-3-O Candida albicans (cluster #3 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50444-2-O Candida parapsilosis (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50452-2-O Trichophyton rubrum (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50458-3-O Leishmania braziliensis (cluster #3 of 4) 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
Z50459-8-O Leishmania donovani (cluster #8 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50460-1-O Leishmania major (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50460-2-O Leishmania major (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50461-1-O Leishmania mexicana (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50467-2-O Trichomonas vaginalis (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50468-4-O Giardia intestinalis (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50501-3-O Gallus gallus (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50512-5-O Cavia porcellus (cluster #5 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
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
Z50529-1-O Cytomegalovirus (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50529-2-O Cytomegalovirus (cluster #2 of 2) 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
Z50587-5-O Homo sapiens (cluster #5 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50588-4-O Canis familiaris (cluster #4 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50589-1-O Felis catus (cluster #1 of 2) 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
Z50594-3-O Mus musculus (cluster #3 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594-4-O Mus musculus (cluster #4 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-11-O Rattus norvegicus (cluster #11 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
Z50600-1-O Vaccinia virus (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50604-1-O Murid herpesvirus 1 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50606-2-O Hepatitis B virus (cluster #2 of 3) 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
Z50607-9-O Human immunodeficiency virus 1 (cluster #9 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
Z50611-3-O Moloney murine leukemia virus (cluster #3 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
Z50612-2-O Moloney murine sarcoma virus (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50643-4-O Hepatitis C virus (cluster #4 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
Z50658-4-O Human immunodeficiency virus 2 (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50674-1-O Human rhinovirus 2 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50681-1-O Duck hepatitis B virus (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50692-1-O Human rhinovirus 16 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50725-4-O Trypanosoma brucei rhodesiense (cluster #4 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50725-7-O Trypanosoma brucei rhodesiense (cluster #7 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50740-1-O Cricetinae gen. sp. (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50755-1-O Anas sp. (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50759-2-O Dictyostelium discoideum (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80001-1-O 143B (cluster #1 of 2) 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
Z80012-1-O A 172 (Glioblastoma cells) (cluster #1 of 1) 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
Z80019-1-O A-427 (Lung carcinoma cells) (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80021-2-O A498 (Renal carcinoma cells) (cluster #2 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80035-5-O B16 (Melanoma cells) (cluster #5 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80035-6-O B16 (Melanoma cells) (cluster #6 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80035-7-O B16 (Melanoma cells) (cluster #7 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80036-2-O BaF3 (IL-3-dependent pro-B-cells) (cluster #2 of 3) 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
Z80040-1-O BHK-21 (Kidney cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80045-1-O BT-20 (Breast carcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80048-1-O BXPC-3 (Pancreatic adenocarcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80049-1-O C3H 10T1/2 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80052-1-O C8166 (Leukemic T-cells) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80054-1-O Caco-2 (Colon adenocarcinoma cells) (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
Z80056-1-O CAKI-2 (Renal carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80063-1-O CCRF S-180 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80064-6-O CCRF-CEM (T-cell leukemia) (cluster #6 of 9) 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
Z80068-2-O CCRF-SB (Lymphoblastic leukemia cells) (cluster #2 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80076-1-O CEM-SS (T-cell leukemia) (cluster #1 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80076-2-O CEM-SS (T-cell leukemia) (cluster #2 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80076-3-O CEM-SS (T-cell leukemia) (cluster #3 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80086-1-O CFPAC-1 (Pancreatic carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80088-1-O CHO (Ovarian cells) (cluster #1 of 4) 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
Z80091-1-O CHO-hD3 (cluster #1 of 1) 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
Z80107-2-O COS-7 (Kidney cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80112-1-O DAN-G (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80113-2-O Daoy (Medulloblastoma cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80120-3-O DLD-1 (Colon adenocarcinoma cells) (cluster #3 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80125-5-O DU-145 (Prostate carcinoma) (cluster #5 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80125-6-O DU-145 (Prostate carcinoma) (cluster #6 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80132-1-O EL4 (Thymoma cells) (cluster #1 of 2) 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
Z80135-1-O F9 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80136-3-O FM3A (Breast carcinoma cells) (cluster #3 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80140-1-O GBM (cluster #1 of 1) 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
Z80152-1-O HCT-8 (Ileocecal adenocarcinoma) (cluster #1 of 2) 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
Z80156-4-O HL-60 (Promyeloblast leukemia cells) (cluster #4 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-5-O HL-60 (Promyeloblast leukemia cells) (cluster #5 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156-6-O HL-60 (Promyeloblast leukemia cells) (cluster #6 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80164-4-O HT-1080 (Fibrosarcoma cells) (cluster #4 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80164-6-O HT-1080 (Fibrosarcoma cells) (cluster #6 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166-8-O HT-29 (Colon adenocarcinoma cells) (cluster #8 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80171-1-O HuTu80 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-10-O K562 (Erythroleukemia cells) (cluster #10 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-7-O K562 (Erythroleukemia cells) (cluster #7 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186-9-O K562 (Erythroleukemia cells) (cluster #9 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80188-1-O KB 3-1 (Cervical epithelial carcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80192-1-O KM12 (Colon adenocarcinoma cells) (cluster #1 of 4) 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
Z80193-10-O L1210 (Lymphocytic leukemia cells) (cluster #10 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193-5-O L1210 (Lymphocytic leukemia cells) (cluster #5 of 12) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193-6-O L1210 (Lymphocytic leukemia cells) (cluster #6 of 12) 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
Z80214-1-O M14 (Melanoma cells) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-4-O MCF7 (Breast carcinoma cells) (cluster #4 of 14) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224-9-O MCF7 (Breast carcinoma cells) (cluster #9 of 14) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80231-1-O MCF7S (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
Z80232-1-O MCF7-VP (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
Z80244-1-O MDA-MB-468 (Breast adenocarcinoma) (cluster #1 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80250-1-O Me665/2/21 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80253-1-O MEF (Embryonic fibroblast cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80254-1-O MES-SA (Uterine sarcoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80255-2-O MES-SA/DxS (Uterine sarcoma cells) (cluster #2 of 2) 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
Z80268-2-O MKN-28 (Gastric epithelial carcinoma cells) (cluster #2 of 2) 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
Z80295-3-O MT4 (Lymphocytes) (cluster #3 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
Z80296-1-O MVLN (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80306-1-O NB-4 (Promyelocytic leukemia cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80316-1-O NCI-H128 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80322-1-O NCI-H358 (Lung carcinama cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80322-2-O NCI-H358 (Lung carcinama cells) (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
Z80346-1-O NUGC (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80347-1-O NUGC-3 (Gastric carcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80356-1-O OVCAR-5 (Ovarian adenocarcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80357-1-O OVCAR-8 (Ovarian adenocarcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80362-5-O P388 (Lymphoma cells) (cluster #5 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80362-6-O P388 (Lymphoma cells) (cluster #6 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
Z80381-1-O PANC-1 (Pancreatic carcinoma 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
Z80407-1-O R1 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80408-1-O R1-CCRF-CEM (Lymphoblastic leukemia) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80410-1-O R2-CCRF-CEM (Lymphoblastic leukemia) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80411-1-O R30dm-CCRF-CEM (Lymphoblastic leukemia) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80418-3-O RAW264.7 (Monocytic-macrophage leukemia cells) (cluster #3 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80429-1-O RPMI 6410 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80433-1-O RPMI-8226 (Multiple myeloma cells) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80443-1-O S180 (Sarcoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80449-1-O SAOS-2 (Osteosarcoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80455-1-O SCC-15 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80457-1-O SCC-25 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80459-1-O SCC-7 (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
Z80475-1-O SK-BR-3 (Breast adenocarcinoma) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80475-2-O SK-BR-3 (Breast adenocarcinoma) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80479-1-O SK-MEL (Melanoma cells) (cluster #1 of 1) 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
Z80488-2-O SK-MEL-5 (Melanoma cells) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80490-4-O SK-MES-1 (cluster #4 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80491-3-O SK-N-MC (Neuroepithelioma cells) (cluster #3 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80493-2-O SK-OV-3 (Ovarian carcinoma cells) (cluster #2 of 6) 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
Z80526-1-O SW480 (Colon adenocarcinoma cells) (cluster #1 of 6) 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
Z80532-5-O T-24 (Bladder carcinoma cells) (cluster #5 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80532-6-O T-24 (Bladder carcinoma cells) (cluster #6 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80548-1-O THP-1 (Acute monocytic leukemia cells) (cluster #1 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80552-1-O TLX-5 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80555-1-O TSGH (cluster #1 of 1) 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
Z80561-1-O U2OS (Osteosarcoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80566-2-O U-937 (Histiocytic lymphoma cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80568-1-O UACC-257 (Melanoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80570-3-O UACC-62 (Melanoma cells) (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80575-1-O UO-31 (Renal carcinoma cells) (cluster #1 of 3) 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
Z80583-2-O Vero (Kidney cells) (cluster #2 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
Z80585-1-O WALKER (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80593-1-O WiDr-NTR (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80606-1-O YOSHIDA (Sarcoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80608-1-O ZR-75-1 (Breast carcinoma cells) (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80641-1-O 791T cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80657-1-O A253 cell line (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
Z80678-1-O AMML cell line (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
Z80712-1-O T47D (Breast carcinoma cells) (cluster #1 of 7) 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
Z80724-1-O C170 cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80742-2-O C6 (Glioma cells) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80751-1-O Caov-3 cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80752-1-O carcinoma cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80773-1-O CHRC/5 cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80774-1-O CHRC5 cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80777-1-O CML/BC cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80783-1-O COLO1 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80789-1-O Colon 38 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80792-1-O Colon 26 (Colon adenocarcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80800-1-O MIA PaCa-2 (Pancreatic carcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80815-1-O D54 cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80823-1-O E6SM (Embryonic skin-muscle fibroblast cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80830-1-O Ehrlich (Ehrlich ascites carcinoma cells) (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
Z80852-1-O A-431 (Epidermoid carcinoma cells) (cluster #1 of 3) 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
Z80865-1-O GHOST CXCR4 cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80870-2-O GM892A cell line (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
Z80877-1-O NCI-H1299 (Non-small cell lung carcinoma) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80878-2-O NCI-H157 (Non-small cell lung carcinoma cells) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80890-1-O H350.3 (MTX-resistant Reuber hepatoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80891-1-O H4 (Hepatoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80893-1-O H35 (Reuber hepatoma cells) (cluster #1 of 1) 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
Z80900-1-O HA22T cell line (cluster #1 of 1) 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
Z80920-1-O HCC 2998 (Colon adenocarcinoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80928-2-O HCT-116 (Colon carcinoma cells) (cluster #2 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80928-7-O HCT-116 (Colon carcinoma cells) (cluster #7 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80936-3-O HEK293 (Embryonic kidney fibroblasts) (cluster #3 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
Z80945-2-O HEp-2 (Laryngeal carcinoma cells) (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80945-3-O HEp-2 (Laryngeal carcinoma cells) (cluster #3 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80947-1-O Hepatoblastoma cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80949-1-O Hepatoma cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80966-1-O HONE1 cell line (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80991-1-O Hs-578T (Breast carcinoma cells) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80996-1-O HT1197 (Bladder carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81001-1-O TSGH 9201 (Gastric carcinoma cells) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81008-1-O Human breast cancer cell lines (cluster #1 of 1) 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
Z81020-4-O HepG2 (Hepatoblastoma cells) (cluster #4 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81020-5-O HepG2 (Hepatoblastoma cells) (cluster #5 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
Z81024-6-O NCI-H460 (Non-small cell lung carcinoma) (cluster #6 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81034-1-O A2780 (Ovarian carcinoma cells) (cluster #1 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81034-10-O A2780 (Ovarian carcinoma cells) (cluster #10 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81034-3-O A2780 (Ovarian carcinoma cells) (cluster #3 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81034-5-O A2780 (Ovarian carcinoma cells) (cluster #5 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81034-6-O A2780 (Ovarian carcinoma cells) (cluster #6 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81041-1-O Prostatic carcinoma cells (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81043-2-O N592 (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81047-2-O Human T-cell line (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81048-1-O TSU (Prostatic carcinoma cells) (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
Z81057-3-O HUVEC (Umbilical vein endothelial cells) (cluster #3 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81072-10-O Jurkat (Acute leukemic T-cells) (cluster #10 of 10) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81072-7-O Jurkat (Acute leukemic T-cells) (cluster #7 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
Z81080-1-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
Z81115-6-O KB (Squamous cell carcinoma) (cluster #6 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81133-1-O L1210 (1565) (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81135-1-O L6 (Skeletal muscle myoblast cells) (cluster #1 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81135-2-O L6 (Skeletal muscle myoblast cells) (cluster #2 of 4) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81138-2-O ScN2a (Scrapie-infected neuroblastoma cells) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81159-1-O Lewis cell line (cluster #1 of 1) 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
Z81170-5-O LNCaP (Prostate carcinoma) (cluster #5 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
Z81184-5-O LOX IMVI (Melanoma cells) (cluster #5 of 5) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81192-1-O PC-8 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81193-1-O PC-9 (cluster #1 of 1) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
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
Z81245-4-O MDA-MB-435 (Breast carcinoma cells) (cluster #4 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-3-O HeLa (Cervical adenocarcinoma cells) (cluster #3 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247-6-O HeLa (Cervical adenocarcinoma cells) (cluster #6 of 9) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81248-1-O Malme-3M (Melanoma cells) (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81248-2-O Malme-3M (Melanoma cells) (cluster #2 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-1-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #1 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-10-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #10 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252-9-O MDA-MB-231 (Breast adenocarcinoma cells) (cluster #9 of 11) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81264-2-O V79 (Lung fibroblasts) (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81280-3-O NCI-H226 (Non-small cell lung carcinoma cells) (cluster #3 of 3) 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
Z81322-1-O SF-539 (Glioblastoma cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81325-1-O SR (Leukemia cells) (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81331-3-O SW-620 (Colon adenocarcinoma cells) (cluster #3 of 6) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81338-1-O T-cells (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase