Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 1' and Ligand = 'BDBM50399700'   

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
Diacylglycerol O-acyltransferase 1 (Homo sapiens (Human))	BDBM50399700 (CHEMBL2178391) Show SMILES Cc1nc(-c2ccccc2)c(nc1-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)C(N)=O |r,wU:19.21,wD:22.25,(28.61,-10.63,;27.27,-9.87,;25.94,-10.64,;24.6,-9.87,;23.28,-10.64,;21.94,-9.87,;20.61,-10.64,;20.61,-12.18,;21.95,-12.95,;23.28,-12.18,;24.6,-8.33,;25.94,-7.56,;27.27,-8.33,;28.6,-7.56,;29.94,-8.34,;31.27,-7.56,;31.27,-6.01,;29.93,-5.25,;28.6,-6.02,;32.6,-5.24,;32.59,-3.7,;33.93,-2.93,;35.27,-3.7,;36.6,-2.93,;37.93,-3.7,;39.27,-2.93,;37.93,-5.24,;35.26,-5.24,;33.94,-6.01,;23.27,-7.56,;21.94,-8.32,;23.27,-6.02,)| Show InChI InChI=1S/C26H27N3O3/c1-16-23(29-25(26(27)32)24(28-16)20-5-3-2-4-6-20)21-13-11-19(12-14-21)18-9-7-17(8-10-18)15-22(30)31/h2-6,11-14,17-18H,7-10,15H2,1H3,(H2,27,32)(H,30,31)/t17-,18-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human recombinant DGAT1 expressed in Sf9 cells by liquid scintillography				J Med Chem 55: 10610-29 (2012) Article DOI: 10.1021/jm301296t BindingDB Entry DOI: 10.7270/Q2XD12T3
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