BDBM50097152 CHEMBL3581149

SMILES COc1cccc(CC(=O)Nc2cc(cs2)-c2ccnc(N)c2)c1

InChI Key InChIKey=MPZKHCPHRLXFAX-UHFFFAOYSA-N

Data  2 KI  1 IC50

  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 = 50097152   

TargetCytochrome P450 3A4(Homo sapiens (Human))
Vertex Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50097152(CHEMBL3581149)
Affinity DataIC50:  5.60E+3nMAssay Description:Inhibition of CYP3A4 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed