Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'ATP-dependent translocase ABCB1' and Ligand = 'BDBM50532707'   

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))	BDBM50532707 (CHEMBL4585968) Show SMILES COc1nonc1OCCOc1ccc(cc1)-c1ccc(CN2CCc3cc(OC)c(OC)cc3C2)cc1 Show InChI InChI=1S/C29H31N3O6/c1-33-26-16-23-12-13-32(19-24(23)17-27(26)34-2)18-20-4-6-21(7-5-20)22-8-10-25(11-9-22)36-14-15-37-29-28(35-3)30-38-31-29/h4-11,16-17H,12-15,18-19H2,1-3H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.600	n/a	n/a	n/a	n/a
Universit£ degli Studi di Torino Via P. Giuria 9 Curated by ChEMBL					Assay Description Inhibition of MDR1 (unknown origin) expressed in MDCK cells assessed as decrease in calcein-AM transport after 30 mins by fluorescence assay				J Med Chem 59: 6729-38 (2016) Article DOI: 10.1021/acs.jmedchem.6b00252 BindingDB Entry DOI: 10.7270/Q28S4TCD
					More data for this Ligand-Target Pair
ATP-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50532707 (CHEMBL4585968) Show SMILES COc1nonc1OCCOc1ccc(cc1)-c1ccc(CN2CCc3cc(OC)c(OC)cc3C2)cc1 Show InChI InChI=1S/C29H31N3O6/c1-33-26-16-23-12-13-32(19-24(23)17-27(26)34-2)18-20-4-6-21(7-5-20)22-8-10-25(11-9-22)36-14-15-37-29-28(35-3)30-38-31-29/h4-11,16-17H,12-15,18-19H2,1-3H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.600	n/a	n/a	n/a	n/a
Universit£ degli Studi di Torino Via P. Giuria 9 Curated by ChEMBL					Assay Description Inhibition of MDR1 (unknown origin) expressed in MDCK cells assessed as decrease in calcein-AM transport after 30 mins by fluorescence assay				J Med Chem 59: 6729-38 (2016) Article DOI: 10.1021/acs.jmedchem.6b00252 BindingDB Entry DOI: 10.7270/Q28S4TCD
					More data for this Ligand-Target Pair