Brief Information of the Compound and Protein
Compound Name
 Compound Info 
1-((2R,3R,4S,5R,6R)-4-Benzyloxy-3,5-dihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yl)-3-[3-((4R,5R)-3,3-dibutyl-7-dimethylamino-4-hydroxy-1,1-dioxo-2,3,4,5-tetrahydro-1H-1lambda(6)-benzo[b]thiepin-5-yl)-phenyl]-urea
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 PubChem ID
CID: 24987685
SID: 56329691
Canonical SMILES
CCCCC1(CCCC)CS(=O)(=O)c2ccc(N(C)C)cc2[C@@H](c2cccc(NC(=O)N[C@@H]3O[C@H](CO)[C@@H](O)[C@H](OCc4ccccc4)[C@H]3O)c2)[C@H]1O
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Compound Formula C40H55N3O9S
Compound Structure
Protein Name
 Protein Info 
Ileal sodium/bile acid cotransporter
Protein Classification
Transporter
>
Electrochemical transporter
>
SLC superfamily of solute carriers
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SLC10 family of sodium-bile acid co-transporters
Uniprot ID
Q12908
Gene Name
SLC10A2
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)  1
1
IC50 = 6.9 nM
   TI
   LI
   LO
   TS