Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid
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 PubChem ID
CID: 10133
SID: 14780857
Canonical SMILES
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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Compound Formula C24H40O4
Compound Structure
Protein Name
 Protein Info 
G-protein coupled bile acid receptor 1
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Small molecule receptor (family A GPCR)
>
Lipid-like ligand receptor (family A GPCR)
>
Steroid-like ligand receptor
Uniprot ID
Q8TDU6
Gene Name
GPBAR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  2
1
EC50 = 6710 nM
   TI
   LI
   LO
   TS
2
EC50 = 15600 nM
   TI
   LI
   LO
   TS
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 6100 nM
   TI
   LI
   LO
   TS
CL000126 NCI-H716
 Cell Line Info 
Homo sapiens (Human)  2
1
EC50 = 6700 nM
   TI
   LI
   LO
   TS
2
EC50 = 33000 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 EC50 = 10290 nM