UCSF

EDASA Scientific

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

Binding 10μM Targets with Highest Number of Available Compounds (118 in total)

Name (Code) Description Organism Class Size Browse Download (Annotations)
5HT2A-1-E Serotonin 2a (5-HT2a) receptor (cluster #1 of 3) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2-8-E Nitric oxide synthase, inducible (cluster #8 of 9) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS3-6-E Nitric oxide synthase, endothelial (cluster #6 of 7) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPBT-1-E Alkaline phosphatase tissue-nonspecific (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A-1-E Serotonin 1a (5-HT1a) receptor (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B-2-E Serotonin 2b (5-HT2b) receptor (cluster #2 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C-2-E Serotonin 2c (5-HT2c) receptor (cluster #2 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R-1-E Serotonin 6 (5-HT6) receptor (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-4-E Carbonic anhydrase I (cluster #4 of 12) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-13-E Carbonic anhydrase II (cluster #13 of 15) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B-2-E Glycogen synthase kinase-3 beta (cluster #2 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3-1-E Dopamine transporter (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1-4-E Sigma opioid receptor (cluster #4 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A-4-E Serotonin 1a (5-HT1a) receptor (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B-1-E Serotonin 1b (5-HT1b) receptor (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D-1-E Serotonin 1d (5-HT1d) receptor (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F-1-E Serotonin 1f (5-HT1f) receptor (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C-1-E Serotonin 2c (5-HT2c) receptor (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A-2-E Serotonin 3a (5-HT3a) receptor (cluster #2 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B-2-E Serotonin 3b (5-HT3b) receptor (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3C-2-E Serotonin 3c (5-HT3c) receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3D-2-E Serotonin 3d (5-HT3d) receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3E-2-E Serotonin 3e (5-HT3e) receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R-2-E Serotonin 6 (5-HT6) receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R-1-E Serotonin 7 (5-HT7) receptor (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4-2-E Beta amyloid A4 protein (cluster #2 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACH10-4-E Neuronal acetylcholine receptor protein alpha-10 subunit (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3-4-E Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #4 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4-1-E Neuronal acetylcholine receptor protein alpha-4 subunit (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A-1-E Alpha-1a adrenergic receptor (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A-2-E Alpha-1a adrenergic receptor (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A-1-E Alpha-2a adrenergic receptor (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A-2-E Alpha-2a adrenergic receptor (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B-2-E Alpha-2b adrenergic receptor (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C2-1-E Aldo-keto reductase family 1 member C2 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C3-1-E Aldo-keto-reductase family 1 member C3 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA-2-E Monoamine oxidase A (cluster #2 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB-2-E Monoamine oxidase B (cluster #2 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
APEX1-1-E DNA-(apurinic or apyrimidinic site) lyase (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
B5SU02-2-E Alpha carbonic anhydrase (cluster #2 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
C0IX24-1-E Carbonic anhydrase (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12-1-E Carbonic anhydrase XII (cluster #1 of 9) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15-2-E Carbonic anhydrase 15 (cluster #2 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-6-E Carbonic anhydrase II (cluster #6 of 15) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3-2-E Carbonic anhydrase III (cluster #2 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A-1-E Carbonic anhydrase VA (cluster #1 of 10) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B-1-E Carbonic anhydrase VB (cluster #1 of 9) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6-7-E Carbonic anhydrase VI (cluster #7 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7-1-E Carbonic anhydrase VII (cluster #1 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9-9-E Carbonic anhydrase IX (cluster #9 of 11) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCR3-1-E C-C chemokine receptor type 3 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE-2-E Butyrylcholinesterase (cluster #2 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP51-1-B Sterol 14-alpha demethylase (cluster #1 of 2) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT-1-B Carbonic anhydrase (cluster #1 of 3) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-20-E Dopamine D2 receptor (cluster #20 of 24) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-9-E Dopamine D2 receptor (cluster #9 of 24) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR-1-E Dihydrofolate reductase (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR-3-B Dihydrofolate reductase (cluster #3 of 4) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EDNRA-3-E Endothelin receptor ET-A (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2-1-E Estrogen receptor beta (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GLRA1-2-E Glycine receptor subunit alpha-1 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GLRA2-2-E Glycine receptor subunit alpha-2 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GLRA3-2-E Glycine receptor alpha-3 chain (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GLRA4-2-E Glycine receptor alpha-4 chain (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GLRB-2-E Glycine receptor beta chain (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRID1-1-E Glutamate receptor delta-1 subunit (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2-2-E HM74 nicotinic acid GPCR (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2-3-E HM74 nicotinic acid GPCR (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2-4-E HM74 nicotinic acid GPCR (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HS90A-3-E Heat shock protein HSP 90-alpha (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
I23O1-3-E Indoleamine 2,3-dioxygenase 1 (cluster #3 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
I23O1-4-E Indoleamine 2,3-dioxygenase 1 (cluster #4 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KIF11-2-E Kinesin-like protein 1 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LEF-2-B Anthrax lethal factor (cluster #2 of 2) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MGLL-2-E Monoglyceride lipase (cluster #2 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMD3A-2-E Glutamate [NMDA] receptor subunit 3A (cluster #2 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMD3A-5-E Glutamate [NMDA] receptor subunit 3A (cluster #5 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMD3B-2-E Glutamate [NMDA] receptor subunit 3B (cluster #2 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMD3B-5-E Glutamate [NMDA] receptor subunit 3B (cluster #5 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE1-2-E Glutamate [NMDA] receptor subunit epsilon 1 (cluster #2 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE1-3-E Glutamate [NMDA] receptor subunit epsilon 1 (cluster #3 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE2-3-E Glutamate [NMDA] receptor subunit epsilon 2 (cluster #3 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE2-4-E Glutamate [NMDA] receptor subunit epsilon 2 (cluster #4 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE3-2-E Glutamate [NMDA] receptor subunit epsilon 3 (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE3-4-E Glutamate [NMDA] receptor subunit epsilon 3 (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE4-2-E Glutamate [NMDA] receptor subunit epsilon 4 (cluster #2 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE4-5-E Glutamate [NMDA] receptor subunit epsilon 4 (cluster #5 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1-2-E Glutamate (NMDA) receptor subunit zeta 1 (cluster #2 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1-3-E Glutamate (NMDA) receptor subunit zeta 1 (cluster #3 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1-4-E Glutamate (NMDA) receptor subunit zeta 1 (cluster #4 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1-5-E Nitric-oxide synthase, brain (cluster #5 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1-6-E Nitric-oxide synthase, brain (cluster #6 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1-7-E Nitric-oxide synthase, brain (cluster #7 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P4K2A-1-E PI4-kinase type II (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P4K2B-1-E PI4-kinase type II beta (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARP1-2-E Poly [ADP-ribose] polymerase 1 (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARP1-3-E Poly [ADP-ribose] polymerase 1 (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PI4KA-1-E PI4-kinase alpha subunit (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PI4KB-2-E PI4-kinase beta subunit (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PLD1-2-E Phospholipase D1 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5AJ71-2-F Carbonic anhydrase (cluster #2 of 4) Fungi 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72874-3-V Human immunodeficiency virus type 1 protease (cluster #3 of 3) Viruses 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q7ZJM1-4-V Human immunodeficiency virus type 1 integrase (cluster #4 of 6) Viruses 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9AQH7-1-B DnaC helicase (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9NFS5-1-E Spermidine synthase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4-3-E Serotonin transporter (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1-1-E Sigma opioid receptor (cluster #1 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1-6-E Sigma opioid receptor (cluster #6 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
T23O-1-E Tryptophan 2,3-dioxygenase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1-2-E Trypsin I (cluster #2 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Y1284-1-B Uncharacterized protein Rv1284/MT1322 (cluster #1 of 2) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104297-3-O Glutamate NMDA receptor; GRIN1/GRIN2B (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104298-2-O Glutamate NMDA receptor; GRIN1/GRIN2A (cluster #2 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301-5-O GABA-A receptor; anion channel (cluster #5 of 8) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302-3-O Glutamate NMDA receptor (cluster #3 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302-4-O Glutamate NMDA receptor (cluster #4 of 7) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304-1-O Adrenergic receptor alpha-1 (cluster #1 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304-3-O Adrenergic receptor alpha-1 (cluster #3 of 3) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase