Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peroxisomal acyl-coenzyme A oxidase 1' and Ligand = 'BDBM50138620'   

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
Peroxisomal acyl-coenzyme A oxidase 1 (Rattus norvegicus)	BDBM50138620 (CHEMBL155166 | N-Cyclohexyl-2-{4-[(R)-2-hydroxy-3-...) Show SMILES Cc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)NC4CCCCC4)CC3)ccc2s1 Show InChI InChI=1S/C23H34N4O3S/c1-17-24-21-13-20(7-8-22(21)31-17)30-16-19(28)14-26-9-11-27(12-10-26)15-23(29)25-18-5-3-2-4-6-18/h7-8,13,18-19,28H,2-6,9-12,14-16H2,1H3,(H,25,29)/t19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
CV Therapeutics Curated by ChEMBL					Assay Description Inhibitory activity against Palmitoyl-CoA oxidase to inhibit rat heart mitochondrial Palmitoyl-CoA oxidation.				Bioorg Med Chem Lett 14: 549-52 (2003) BindingDB Entry DOI: 10.7270/Q2GH9HD4
					More data for this Ligand-Target Pair