BDBM50466799 CHEMBL4281681

SMILES Oc1ccc2c(Oc3cc(O)ccc3C22OC(=O)c3cc(NC(=S)NCCCCCCOc4ccc(\C=C\C(=O)c5c(O)c6ccccc6oc5=O)cc4)ccc23)c1

InChI Key InChIKey=RXBBWPDXAZKOMQ-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  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 = 50466799   

TargetNAD(P)H dehydrogenase [quinone] 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50466799(CHEMBL4281681)
Affinity DataIC50: 980nMAssay Description:Inhibition of recombinant human NQO1 assessed as reduction in oxidation of NADPH to NADP+ using b-lap as substrate and NADPH in presence of 0.14% (w/...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetNAD(P)H dehydrogenase [quinone] 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50466799(CHEMBL4281681)
Affinity DataEC50:  2.95E+3nMAssay Description:Binding affinity to recombinant human NQO1 by fluorescence polarization competition assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed