BDBM50562981 CHEMBL4762497

SMILES Cc1ccc(NC(=O)CCC(=O)OCCCCCCSc2ccc([N+]([O-])=O)c3nonc23)cc1

InChI Key InChIKey=KDDWUUCIIKUEJN-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50562981   

TargetGlutathione S-transferase P(Human)
Southeast University

Curated by ChEMBL
LigandPNGBDBM50562981(CHEMBL4762497)
Affinity DataIC50: 6.80E+3nMAssay Description:Inhibition of GSTP1-1 (unknown origin) using reduced GSH and CDNB as substrate incubated for 10 mins followed by substrate addition by microplate rea...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/29/2022
Entry Details Article
PubMed
TargetGlutathione S-transferase Mu 2(Human)
Southeast University

Curated by ChEMBL
LigandPNGBDBM50562981(CHEMBL4762497)
Affinity DataIC50: 390nMAssay Description:Inhibition of GSTM2-2 (unknown origin) using reduced GSH and CDNB as substrate incubated for 10 mins followed by substrate addition by microplate rea...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/29/2022
Entry Details Article
PubMed