Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Polyunsaturated fatty acid 5-lipoxygenase' and Ligand = 'BDBM50059718'   

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
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50059718 (4-Furan-3-yl-7-[7-(4-hydroxy-tetrahydro-pyran-4-yl...) Show SMILES OC1(CCOCC1)c1ccc2ccc(COc3ccc4c(cc(cc4c3)C#N)-c3ccoc3)nc2c1 Show InChI InChI=1S/C30H24N2O4/c31-17-20-13-23-15-26(5-6-27(23)28(14-20)22-7-10-35-18-22)36-19-25-4-2-21-1-3-24(16-29(21)32-25)30(33)8-11-34-12-9-30/h1-7,10,13-16,18,33H,8-9,11-12,19H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description Inhibition of oxidation of arachidonic acid by human 5-Lipoxygenase using spectrophotometric assay				J Med Chem 40: 2866-75 (1997) Article DOI: 10.1021/jm970046b BindingDB Entry DOI: 10.7270/Q2QN67G4
					More data for this Ligand-Target Pair