Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Lysosomal acid lipase/cholesteryl ester hydrolase' and Ligand = 'BDBM50287471'   

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
Lysosomal acid lipase/cholesteryl ester hydrolase (Homo sapiens (Human))	BDBM50287471 (1-(4-tert-Butyl-cyclohexyl)-3,3,4,4,4-pentafluoro-...) Show SMILES CC(C)(C)[C@H]1CC[C@H](CC(=O)C(F)(F)C(F)(F)F)CC1 |wU:7.7,wD:4.3,(5.46,-3.34,;5.46,-4.89,;5.85,-6.38,;6.79,-5.67,;4.12,-5.66,;2.79,-4.88,;1.47,-5.66,;1.47,-7.2,;.13,-7.97,;-1.21,-7.2,;-1.21,-5.66,;-2.54,-7.97,;-3.87,-7.2,;-2.94,-6.48,;-2.54,-9.52,;-3.87,-10.28,;-1.2,-10.28,;-4.03,-9.12,;2.79,-7.97,;4.12,-7.2,)| Show InChI InChI=1S/C14H21F5O/c1-12(2,3)10-6-4-9(5-7-10)8-11(20)13(15,16)14(17,18)19/h9-10H,4-8H2,1-3H3/t9-,10-	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of ancreatic cholesterol esterase using using p-nitrophenylacetate or cholesteryl [1-14C]-oleate as substrates				Bioorg Med Chem Lett 6: 1673-1676 (1996) Article DOI: 10.1016/0960-894X(96)00290-9 BindingDB Entry DOI: 10.7270/Q2H70FSC
					More data for this Ligand-Target Pair