BDBM50242252 CHEMBL4071511

SMILES CCOC(=O)C1=C(C)NC(C)=C(C1c1c(C)onc1-c1ccccc1Br)C(=O)OCc1cn(CCOCCOCCOCCOCCOCCn2cc(COC(=O)C3=C(C)NC(C)=C(C3c3c(C)onc3-c3ccccc3Br)C(=O)OCC)nn2)nn1

InChI Key InChIKey=BZIQEKUXLTYGGM-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 = 50242252   

TargetATP-dependent translocase ABCB1(Human)
University of Montana

Curated by ChEMBL
LigandPNGBDBM50242252(CHEMBL4071511)
Affinity DataIC50: 2.86E+3nMAssay Description:Inhibition of MDR-1 in human Caco-2 cells after 30 mins by calcein-AM dye based fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/14/2019
Entry Details Article
PubMed