BDBM50135029 1-(5-(benzyloxy)-2-(3-(4-benzylpiperazin-1-yl)-2-hydroxypropoxy)phenyl)-3-phenylpropan-1-one::1-{5-Benzyloxy-2-[3-(4-benzyl-piperazin-1-yl)-2-hydroxy-propoxy]-phenyl}-3-phenyl-propan-1-one::CHEMBL144148

SMILES: OC(COc1ccc(OCc2ccccc2)cc1C(=O)CCc1ccccc1)CN1CCN(Cc2ccccc2)CC1

InChI Key: InChIKey=GUKJTWYUEMCIOS-UHFFFAOYSA-N

Data: 1 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50135029   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
P-glycoprotein 1 (Homo sapiens (Human))	BDBM50135029 (1-(5-(benzyloxy)-2-(3-(4-benzylpiperazin-1-yl)-2-h...) Show SMILES OC(COc1ccc(OCc2ccccc2)cc1C(=O)CCc1ccccc1)CN1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C36H40N2O4/c39-32(26-38-22-20-37(21-23-38)25-30-12-6-2-7-13-30)28-42-36-19-17-33(41-27-31-14-8-3-9-15-31)24-34(36)35(40)18-16-29-10-4-1-5-11-29/h1-15,17,19,24,32,39H,16,18,20-23,25-28H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	116	n/a	n/a	n/a	n/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