BDBM50005006 CHEMBL2397307

SMILES CC(=O)N1[C@@H](CC[C@@H]1c1ccccc1)C(=O)Nc1ncc(s1)-c1ccc(N)cc1

InChI Key InChIKey=CJQUPESWNTXRJX-MOPGFXCFSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50005006   

TargetCytochrome P450 3A4(Homo sapiens (Human))
Boehringer Ingelheim (Canada)

Curated by ChEMBL
LigandPNGBDBM50005006(CHEMBL2397307)
Affinity DataIC50:  980nMAssay Description:Inhibition of CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed