BDBM50066269 CHEMBL3401541

SMILES COCCCOc1cc(ccc1OC)C(=O)N(C[C@@H]1CNC[C@H]1NS(=O)(=O)Cc1ccccc1)C(C)C

InChI Key InChIKey=WPSURGXSNWIBBJ-BJKOFHAPSA-N

Data  9 IC50

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 = 50066269   

TargetCytochrome P450 3A4(Homo sapiens (Human))
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50066269(CHEMBL3401541)
Affinity DataIC50:  4.40E+3nMAssay Description:Inhibition of CYP3A4 (unknown origin) using midazolam fluorometric substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Novartis Pharma

Curated by ChEMBL
LigandPNGBDBM50066269(CHEMBL3401541)
Affinity DataIC50: >3.00E+4nMAssay Description:Inhibition of CYP3A4 (unknown origin) using DBF fluorometric substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed