Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sterol O-acyltransferase 1' and Ligand = 'BDBM50038906'   

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
Sterol O-acyltransferase 1 (Rattus norvegicus)	BDBM50038906 (1-[8-Chloro-4-(2-chloro-phenyl)-6-methyl-quinolin-...) Show SMILES Cc1cc(Cl)c2ncc(NC(=O)Nc3ccc(F)cc3F)c(-c3ccccc3Cl)c2c1 |(2.12,-4.41,;3.45,-3.62,;3.45,-2.08,;4.78,-1.31,;4.77,.23,;6.12,-2.08,;7.44,-1.31,;8.78,-2.06,;8.78,-3.62,;10.13,-4.37,;11.46,-3.6,;11.44,-2.06,;12.79,-4.37,;12.79,-5.91,;11.46,-6.68,;11.48,-8.22,;12.82,-8.98,;12.83,-10.52,;14.15,-8.2,;14.14,-6.66,;15.47,-5.88,;7.45,-4.39,;7.45,-5.93,;6.12,-6.7,;6.12,-8.24,;7.45,-9.01,;8.8,-8.22,;8.8,-6.7,;10.29,-7.09,;6.12,-3.62,;4.79,-4.39,)| Show InChI InChI=1S/C23H15Cl2F2N3O/c1-12-8-15-21(14-4-2-3-5-16(14)24)20(11-28-22(15)17(25)9-12)30-23(31)29-19-7-6-13(26)10-18(19)27/h2-11H,1H3,(H2,29,30,31)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	8.90	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Chemical Industries, Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against acyl coenzyme A:cholesterol acyltransferase in rat microsomes				J Med Chem 37: 2079-84 (1994) BindingDB Entry DOI: 10.7270/Q23F4NPC
					More data for this Ligand-Target Pair