BDBM50236240 5alpha-androstan-3beta-OL-17-one::CHEMBL272195::Epiandrosterone::epi-andosterone

SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@]34C)[C@@H]1CCC2=O

InChI Key InChIKey=QGXBDMJGAMFCBF-LUJOEAJASA-N

Data  4 KI  2 IC50  1 EC50

PDB links: 5 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50236240   

TargetG-protein coupled bile acid receptor 1(Homo sapiens (Human))
Centre National de la Recherche Scientifique/INSERM/ULP

Curated by ChEMBL
LigandPNGBDBM50236240(5alpha-androstan-3beta-OL-17-one | CHEMBL272195 | ...)
Affinity DataEC50:  3.20E+3nMAssay Description:Agonist activity at human TGR5 expressed in CHO cells by luciferase assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed