BDBM50301754 CHEMBL578970::isopropyl 2-cyano-6-(3-fluorobenzoyl)-4,4-dimethyl-1,4,5,6-tetrahydropyrrolo[3,2-d]azepine-8-carboxylate

SMILES CC(C)OC(=O)C1=CN(CC(C)(C)c2cc([nH]c12)C#N)C(=O)c1cccc(F)c1

InChI Key InChIKey=ZYFPATDFWJXJGF-UHFFFAOYSA-N

Data  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50301754   

TargetBile acid receptor(Human)
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50301754(isopropyl 2-cyano-6-(3-fluorobenzoyl)-4,4-dimethyl...)
Affinity DataEC50:  2.5nMAssay Description:Agonist activity at gal4-tagged human FXR-ligand binding domain expressed in human HEK293 cells by luciferase reporter gene assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2010
Entry Details Article
PubMed
TargetBile acid receptor(Human)
Wyeth Research

Curated by ChEMBL
LigandPNGBDBM50301754(isopropyl 2-cyano-6-(3-fluorobenzoyl)-4,4-dimethyl...)
Affinity DataEC50:  3nMAssay Description:Agonist activity at human Gal4-fused FXR expressed in human HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2024
Entry Details
PubMed