Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Hormone-sensitive lipase' and Ligand = 'BDBM120367'   

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
Hormone-sensitive lipase (Homo sapiens (Human))	BDBM120367 (US8703807, 3) Show SMILES CC(C)Oc1ccc(cc1)N1CC[C@]2(CC[C@@](O)(CN3CCCC3=O)CC2)C1=O |r,wU:13.29,16.17,wD:16.18,(9.44,-.29,;7.95,-.69,;7.55,-2.18,;6.86,.4,;5.38,-0,;4.98,-1.49,;3.49,-1.89,;2.4,-.8,;2.8,.69,;4.29,1.09,;.91,-1.2,;.44,-2.66,;-1.1,-2.66,;-1.58,-1.2,;-1.98,.29,;-3.46,.69,;-4.55,-.4,;-5.64,.69,;-6.04,-.8,;-7.13,.29,;-6.65,1.76,;-7.9,2.66,;-9.15,1.76,;-8.67,.29,;-9.44,-1.04,;-4.15,-1.89,;-2.67,-2.29,;-.33,-.29,;-.33,1.25,)| Show InChI InChI=1S/C23H32N2O4/c1-17(2)29-19-7-5-18(6-8-19)25-15-13-22(21(25)27)9-11-23(28,12-10-22)16-24-14-3-4-20(24)26/h5-8,17,28H,3-4,9-16H2,1-2H3/t22-,23+	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	50.9	n/a	n/a	n/a	n/a	7.2	4
Hoffmann-La Roche Inc. US Patent					Assay Description HSL enzyme activity was measured by a colorimetric assay using 2,3-dimercapto-1-propanol tributyrate (Aldrich, St. Louis, Mo.) as a substrate. Typica...				US Patent US8703807 (2014) BindingDB Entry DOI: 10.7270/Q2RN36HB
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