Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ATP-dependent translocase ABCB1' and Ligand = 'BDBM50410194'   

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))	BDBM50410194 (CHEMBL189669) Show SMILES CCCOc1cc2oc(cc(=O)c2c(OC)c1OCCC)-c1ccccc1 Show InChI InChI=1S/C22H24O5/c1-4-11-25-19-14-18-20(22(24-3)21(19)26-12-5-2)16(23)13-17(27-18)15-9-7-6-8-10-15/h6-10,13-14H,4-5,11-12H2,1-3H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description TP_TRANSPORTER: increase in Vinblastine intracellular accumulation in KB/MDR cells				J Med Chem 47: 5555-66 (2004) Article DOI: 10.1021/jm049949c BindingDB Entry DOI: 10.7270/Q27S7Q02
					More data for this Ligand-Target Pair