Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Polyunsaturated fatty acid 5-lipoxygenase' and Ligand = 'BDBM50339580'   

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))	BDBM50339580 (4'-[1-(3-Phenyl-propyl)-1H-[1,2,3]triazol-4-yl]-bi...) Show SMILES Oc1ccc(cc1)-c1ccc(cc1)-c1cn(CCCc2ccccc2)nn1 Show InChI InChI=1S/C23H21N3O/c27-22-14-12-20(13-15-22)19-8-10-21(11-9-19)23-17-26(25-24-23)16-4-7-18-5-2-1-3-6-18/h1-3,5-6,8-15,17,27H,4,7,16H2	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	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Salerno Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in human neutrophils				J Med Chem 54: 1565-75 (2011) Article DOI: 10.1021/jm101238d BindingDB Entry DOI: 10.7270/Q2SN098M
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50339580 (4'-[1-(3-Phenyl-propyl)-1H-[1,2,3]triazol-4-yl]-bi...) Show SMILES Oc1ccc(cc1)-c1ccc(cc1)-c1cn(CCCc2ccccc2)nn1 Show InChI InChI=1S/C23H21N3O/c27-22-14-12-20(13-15-22)19-8-10-21(11-9-19)23-17-26(25-24-23)16-4-7-18-5-2-1-3-6-18/h1-3,5-6,8-15,17,27H,4,7,16H2	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	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Salerno Curated by ChEMBL					Assay Description Inhibition of human recombinant 5-lipooxygenase expressed in Escherichia coli MV1190 by cell free assay				J Med Chem 54: 1565-75 (2011) Article DOI: 10.1021/jm101238d BindingDB Entry DOI: 10.7270/Q2SN098M
					More data for this Ligand-Target Pair