BDBM50288831 CHEMBL4161738

SMILES COc1cc(cc(OC)c1OC)-c1nc(SCC(=O)NC(=O)Nc2ccccn2)nc(Nc2cccc(Cl)c2)c1C#N

InChI Key InChIKey=XKSQWVMTWOYNDS-UHFFFAOYSA-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 = 50288831   

TargetCytochrome P450 3A4(Human)
Zhengzhou University

Curated by ChEMBL
LigandPNGBDBM50288831(CHEMBL4161738)
Affinity DataIC50: 1.72E+4nMAssay Description:Inhibition of recombinant human CYP3A4 in presence of NADPH generating system by fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/26/2020
Entry Details Article
PubMed