BDBM50569591 CHEMBL4854082

SMILES CC(C)(C)c1ccc(cc1)C(=O)Nc1ccccc1C(=O)Nc1ccc(cc1)C(O)=O

InChI Key InChIKey=JNIQPWWGQWIPLQ-UHFFFAOYSA-N

Data  2 EC50

PDB links: 1 PDB ID matches 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 2 hits for monomerid = 50569591   

TargetBile acid receptor(Human)
Computer-Aided Molecular Modeling Research Center

Curated by ChEMBL
LigandPNGBDBM50569591(CHEMBL4854082)
Affinity DataEC50:  350nMAssay Description:Partial agonist activity at human FXR LBD assessed as induction of biotinylated coactivator SRC1 peptide recruitment measured after 2 hrs by FRET ass...More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetBile acid receptor(Human)
Computer-Aided Molecular Modeling Research Center

Curated by ChEMBL
LigandPNGBDBM50569591(CHEMBL4854082)
Affinity DataEC50:  280nMAssay Description:Agonist activity at human FXRMore data for this Ligand-Target Pair
In DepthDetails
PubMedPDB3D3D Structure (crystal)