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SMILES: Cc1ccc(N2CCN(CC(O)COc3cccc4CC(Cc5ccccc5)C(=O)c34)CC2)c(C)c1

InChI Key: InChIKey=GRSVKUQNILOHQT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50207932   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
ATP-dependent translocase ABCB1


(Homo sapiens (Human))		BDBM50207932
PNG
(2-benzyl-7-(3-(4-(2,4-dimethylphenyl)piperazin-1-y...)
Show SMILES Cc1ccc(N2CCN(CC(O)COc3cccc4CC(Cc5ccccc5)C(=O)c34)CC2)c(C)c1
Show InChI InChI=1S/C31H36N2O3/c1-22-11-12-28(23(2)17-22)33-15-13-32(14-16-33)20-27(34)21-36-29-10-6-9-25-19-26(31(35)30(25)29)18-24-7-4-3-5-8-24/h3-12,17,26-27,34H,13-16,18-21H2,1-2H3
PDB

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antibodypedia
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UniChem

Similars
Article
PubMed
n/an/an/an/a 167n/an/an/an/a



University of Vienna

Curated by ChEMBL


Assay Description
Inhibition of P-glycoprotein expressed in MDR CCRF vcr1000 cells by daunorubicin efflux assay

J Med Chem 50: 1698-702 (2007)


Article DOI: 10.1021/jm060604z
BindingDB Entry DOI: 10.7270/Q2SB46JC
More data for this
Ligand-Target Pair