UCSF

ChemDiv BB Make-on-demand

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

Binding 10μM Targets with Highest Number of Available Compounds (121 in total)

Name (Code) Description Organism Class Size Browse Download (Annotations)
MGLL-2-E Monoglyceride lipase (cluster #2 of 7) Eukaryotes 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D1-1-E Voltage-gated calcium channel alpha2/delta subunit 1 (cluster #1 of 4) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPM-3-B Methionine aminopeptidase (cluster #3 of 3) Bacteria 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACH10-2-E Neuronal acetylcholine receptor protein alpha-10 subunit (cluster #2 of 4) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST1-1-E Carboxylesterase (cluster #1 of 7) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B-2-E Glycogen synthase kinase-3 beta (cluster #2 of 7) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3-4-E Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #4 of 5) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4-1-E Neuronal acetylcholine receptor protein alpha-4 subunit (cluster #1 of 5) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
LIMK1-1-E LIM domain kinase 1 (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301-1-O GABA-A receptor; anion channel (cluster #1 of 8) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B-1-E Serotonin 1b (5-HT1b) receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D-1-E Serotonin 1d (5-HT1d) receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A-2-E Alpha-1a adrenergic receptor (cluster #2 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A-2-E Alpha-2a adrenergic receptor (cluster #2 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC1-1-E Histone deacetylase 1 (cluster #1 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC3-1-E Histone deacetylase 3 (cluster #1 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
THRB-8-E Prothrombin (cluster #8 of 8) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1-4-E Trypsin I (cluster #4 of 5) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY2-3-E Trypsin II (cluster #3 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A-3-E Serotonin 1a (5-HT1a) receptor (cluster #3 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C-1-E Serotonin 2c (5-HT2c) receptor (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A-2-E Serotonin 3a (5-HT3a) receptor (cluster #2 of 5) 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
ACHA-2-E Acetylcholine receptor protein alpha chain (cluster #2 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA2-4-E Neuronal acetylcholine receptor protein alpha-2 subunit (cluster #4 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA5-4-E Neuronal acetylcholine receptor protein alpha-5 subunit (cluster #4 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA6-4-E Neuronal acetylcholine receptor subunit alpha-6 (cluster #4 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7-1-E Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #1 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7-5-E Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #5 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA9-4-E Neuronal acetylcholine receptor protein alpha-9 subunit (cluster #4 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB-1-E Acetylcholine receptor protein beta chain (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB2-4-E Neuronal acetylcholine receptor protein beta-2 subunit (cluster #4 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB3-4-E Neuronal acetylcholine receptor subunit beta-3 (cluster #4 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4-5-E Neuronal acetylcholine receptor subunit beta-4 (cluster #5 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2-5-E Muscarinic acetylcholine receptor M2 (cluster #5 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK2-1-E Cyclin-dependent kinase 2 (cluster #1 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3A-2-E Glycogen synthase kinase-3 alpha (cluster #2 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B-3-E Glycogen synthase kinase-3 beta (cluster #3 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GYRA-1-B DNA gyrase subunit A (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GYRB-1-B DNA gyrase subunit B (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2-1-E HERG (cluster #1 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNN3-1-E Small conductance calcium-activated potassium channel protein 3 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARC-1-B Topoisomerase IV subunit A (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARP1-2-E Poly [ADP-ribose] polymerase 1 (cluster #2 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDK1-3-E Pyruvate dehydrogenase kinase isoform 1 (cluster #3 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDK2-1-E Pyruvate dehydrogenase kinase isoform 2 (cluster #1 of 2) 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
Z104283-1-O Neuronal acetylcholine receptor; alpha4/beta2 (cluster #1 of 4) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302-4-O Glutamate NMDA receptor (cluster #4 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A-1-E Serotonin 1a (5-HT1a) receptor (cluster #1 of 4) Eukaryotes 1 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
5HT1F-1-E Serotonin 1f (5-HT1f) receptor (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A-1-E Serotonin 2a (5-HT2a) receptor (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A-2-E Serotonin 2a (5-HT2a) receptor (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B-1-E Serotonin 2b (5-HT2b) receptor (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C-2-E Serotonin 2c (5-HT2c) receptor (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B-1-E Serotonin 3b (5-HT3b) receptor (cluster #1 of 4) 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
5HT4R-1-E Serotonin 4 (5-HT4) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R-2-E Serotonin 7 (5-HT7) receptor (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A3EZI9-1-V Hepatitis C virus NS3 protease/helicase (cluster #1 of 3) Viruses 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
ACM1-3-E Muscarinic acetylcholine receptor M1 (cluster #3 of 5) 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
AMPM-1-B Methionine aminopeptidase (cluster #1 of 3) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPM2-2-E Methionine aminopeptidase 2 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BTK-1-E Tyrosine-protein kinase BTK (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CASP3-1-E Caspase-3 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CATK-2-E Cathepsin K (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHK2-1-E Serine/threonine-protein kinase Chk2 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLK1-2-E Dual specificty protein kinase CLK1 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSF1R-1-E Macrophage colony-stimulating factor 1 receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1-1-E Dopamine D1 receptor (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-2-E Dopamine D2 receptor (cluster #2 of 24) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRTS-1-E Bifunctional dihydrofolate reductase-thymidylate synthase (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR1A-1-E Dual specificity tyrosine-phosphorylation-regulated kinase 1A (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR-1-E Epidermal growth factor receptor erbB1 (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FA10-2-E Coagulation factor X (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABP4-3-E Fatty acid binding protein adipocyte (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPH-2-E Fatty acid binding protein muscle (cluster #2 of 3) 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
HDAC2-1-E Histone deacetylase 2 (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC2-2-E Histone deacetylase 2 (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC2-3-E Histone deacetylase 2 (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3-1-E Histamine H3 receptor (cluster #1 of 3) 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
IKKA-2-E Inhibitor of nuclear factor kappa B kinase alpha subunit (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
IKKB-1-E Inhibitor of nuclear factor kappa B kinase beta subunit (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KS6A3-1-E Ribosomal protein S6 kinase alpha 3 (cluster #1 of 1) 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
MK08-1-E Mitogen-activated protein kinase 8 (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK10-1-E c-Jun N-terminal kinase 3 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1A-1-E Melatonin receptor 1A (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1B-1-E Melatonin receptor 1B (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1C-1-E Melatonin receptor 1C (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1-1-E Glutamate (NMDA) receptor subunit zeta 1 (cluster #1 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
NOS1-4-E Nitric-oxide synthase, brain (cluster #4 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2-1-E Nitric oxide synthase, inducible (cluster #1 of 9) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA-2-E D-amino-acid oxidase (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4B-2-E Phosphodiesterase 4B (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4D-2-E Phosphodiesterase 4D (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PERM-1-E Myeloperoxidase (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PERM-2-E Myeloperoxidase (cluster #2 of 2) 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
PNMT-1-E Phenylethanolamine N-methyltransferase (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PNPH-1-E Purine-nucleoside phosphorylase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q862F3-2-E Tubulin alpha chain (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q862L2-2-E Tubulin alpha-1 chain (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9AQH7-1-B DnaC helicase (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A2-2-E Norepinephrine transporter (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3-3-E Dopamine transporter (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4-1-E Serotonin transporter (cluster #1 of 4) 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
TBB2B-1-E Tubulin beta chain (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
THRB-5-E Prothrombin (cluster #5 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1-1-E Trypsin I (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TTHY-1-E Transthyretin (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VCAM1-1-E Vascular cell adhesion protein 1 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104294-1-O Cyclin-dependent kinase 5/CDK5 activator 1 (cluster #1 of 2) Other 1 Annotations Catalogs SMILES SDF Mol2 Flexibase