Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Polyunsaturated fatty acid lipoxygenase ALOX15' and Ligand = 'BDBM50347316'   

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 lipoxygenase ALOX15 (Oryctolagus cuniculus (rabbit))	BDBM50347316 (CHEMBL1796838) Show SMILES CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(Cc2ccccc2)[nH]nc1-c1ccccc1 Show InChI InChI=1S/C29H33N3O2S/c1-2-3-6-11-23-16-18-26(19-17-23)35(33,34)30-21-20-27-28(22-24-12-7-4-8-13-24)31-32-29(27)25-14-9-5-10-15-25/h4-5,7-10,12-19,30H,2-3,6,11,20-22H2,1H3,(H,31,32)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	158	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of rabbit 15-LO using linoleic acid by standard colorimetric assay				Bioorg Med Chem Lett 21: 4141-5 (2011) Article DOI: 10.1016/j.bmcl.2011.05.107 BindingDB Entry DOI: 10.7270/Q2028RW3
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid lipoxygenase ALOX15 (Oryctolagus cuniculus (rabbit))	BDBM50347316 (CHEMBL1796838) Show SMILES CCCCCc1ccc(cc1)S(=O)(=O)NCCc1c(Cc2ccccc2)[nH]nc1-c1ccccc1 Show InChI InChI=1S/C29H33N3O2S/c1-2-3-6-11-23-16-18-26(19-17-23)35(33,34)30-21-20-27-28(22-24-12-7-4-8-13-24)31-32-29(27)25-14-9-5-10-15-25/h4-5,7-10,12-19,30H,2-3,6,11,20-22H2,1H3,(H,31,32)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	918	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of rabbit 15-LO using arachidonic acid by standard colorimetric assay				Bioorg Med Chem Lett 21: 4141-5 (2011) Article DOI: 10.1016/j.bmcl.2011.05.107 BindingDB Entry DOI: 10.7270/Q2028RW3
					More data for this Ligand-Target Pair