Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ATP-dependent translocase ABCB1' and Ligand = 'BDBM50135022'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50135022 (1-[2-(2-Hydroxy-3-piperidin-1-yl-propoxy)-phenyl]-...) Show SMILES OC(COc1ccccc1C(=O)CCc1cccc2ccccc12)CN1CCCCC1 Show InChI InChI=1S/C27H31NO3/c29-23(19-28-17-6-1-7-18-28)20-31-27-14-5-4-13-25(27)26(30)16-15-22-11-8-10-21-9-2-3-12-24(21)22/h2-5,8-14,23,29H,1,6-7,15-20H2	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	172	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