UCSF

Aronis BB Make-on-demand

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

Binding 10μM Targets with Highest Number of Available Compounds (51 in total)

Name (Code) Description Organism Class Size Browse Download (Annotations)
SGMR1-1-E Sigma opioid receptor (cluster #1 of 6) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB-1-E Monoamine oxidase B (cluster #1 of 8) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2-2-E HM74 nicotinic acid GPCR (cluster #2 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PNMT-1-E Phenylethanolamine N-methyltransferase (cluster #1 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2-1-E HM74 nicotinic acid GPCR (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5-6-E Arachidonate 5-lipoxygenase (cluster #6 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1-2-E Cyclooxygenase-1 (cluster #2 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2-3-E Cyclooxygenase-2 (cluster #3 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARA-1-E Peroxisome proliferator-activated receptor alpha (cluster #1 of 3) Eukaryotes 2 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
ACES-5-E Acetylcholinesterase (cluster #5 of 12) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A-3-E Alpha-2a adrenergic receptor (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B-4-E Alpha-2b adrenergic receptor (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C-3-E Alpha-2c adrenergic receptor (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA-1-E Monoamine oxidase A (cluster #1 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB-6-E Monoamine oxidase B (cluster #6 of 8) 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
CA2D1-1-E Voltage-gated calcium channel alpha2/delta subunit 1 (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH-1-A Carbonic anhydrase (cluster #1 of 2) Archaea 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-4-E Carbonic anhydrase I (cluster #4 of 12) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-5-E Carbonic anhydrase I (cluster #5 of 12) 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
CAH13-1-E Carbonic anhydrase XIII (cluster #1 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14-1-E Carbonic anhydrase XIV (cluster #1 of 8) 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
CAH2-5-E Carbonic anhydrase II (cluster #5 of 15) 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
CAH4-1-E Carbonic anhydrase IV (cluster #1 of 16) 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
CAH9-1-E Carbonic anhydrase IX (cluster #1 of 11) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAN-1-F Carbonic anhydrase (cluster #1 of 3) Fungi 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT-1-B Carbonic anhydrase (cluster #1 of 3) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4-2-E Dopamine D4 receptor (cluster #2 of 4) 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
FDFT-4-E Squalene synthetase (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GPR44-1-E G protein-coupled receptor 44 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NISCH-3-E Nischarin (cluster #3 of 4) 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
P96878-1-B PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) (cluster #1 of 2) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PD2R-2-E Prostanoid DP receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1-4-E Cyclooxygenase-1 (cluster #4 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2-1-E Cyclooxygenase-2 (cluster #1 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG-1-E Peroxisome proliferator-activated receptor gamma (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PYRD-1-E Dihydroorotate dehydrogenase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5AJ71-1-F Carbonic anhydrase (cluster #1 of 4) Fungi 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1-1-E Trypsin I (cluster #1 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