BDBM50631712 CHEMBL5399482

SMILES COc1cc(OC)c(Cl)c2O[C@]3([C@H](C)CC(=O)C([C@H](CC(=O)NCCc4cc(OC)c(OC)cc4[N+]([O-])=O)c4ccc(SC)cc4)=C3O)C(=O)c12

InChI Key InChIKey=NSQDZNUNHKIWLF-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50631712   

TargetATP-dependent translocase ABCB1(Human)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50631712(CHEMBL5399482)
Affinity DataIC50: 2.40E+3nMAssay Description:Inhibition of human recombinant P-gp ATPase activity in isolated membranes incubated in presence of verapamil by firefly luciferase based luminescenc...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2024
Entry Details
PubMed