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SMILES: Cc1ccccc1N1CCN(CC(O)COc2ccc(cc2)C(=O)c2ccccc2)CC1

InChI Key: InChIKey=MVWWYUZPHVDEHS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50485464   
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))		BDBM50485464
PNG
(CHEMBL2059232)
Show SMILES Cc1ccccc1N1CCN(CC(O)COc2ccc(cc2)C(=O)c2ccccc2)CC1
Show InChI InChI=1S/C27H30N2O3/c1-21-7-5-6-10-26(21)29-17-15-28(16-18-29)19-24(30)20-32-25-13-11-23(12-14-25)27(31)22-8-3-2-4-9-22/h2-14,24,30H,15-20H2,1H3
PDB

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PC cid
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UniChem
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PubMed
n/an/a 500n/an/an/an/an/an/a



University of Vienna

Curated by ChEMBL


Assay Description
Inhibition of P-glycoprotein-mediated daunorubicin efflux from human CCRF-CEM/VCR1000 cells after 240 secs by FACS flow cytometric analysis

J Med Chem 55: 3261-73 (2012)


Article DOI: 10.1021/jm201705f
BindingDB Entry DOI: 10.7270/Q2ZP48ZK
More data for this
Ligand-Target Pair