Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Polyunsaturated fatty acid 5-lipoxygenase' and Ligand = 'BDBM50014190'   

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 (Rattus norvegicus)	BDBM50014190 (2-Dimethylamino-5-phenylsulfanyl-hexa-2,4-dienedio...) Show SMILES CCOC(=O)C(Sc1ccccc1)=CC=C(N(C)C)C(=O)OCC Show InChI InChI=1S/C18H23NO4S/c1-5-22-17(20)15(19(3)4)12-13-16(18(21)23-6-2)24-14-10-8-7-9-11-14/h7-13H,5-6H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Recherches de Vitry Curated by ChEMBL					Assay Description Iin vitro inhibition of 5-lipoxygenase activity in rat basophil leukemia type 1(RBL1) cell homogenates, (reduction of [14C]-5-HETE formation)				J Med Chem 33: 2744-9 (1990) BindingDB Entry DOI: 10.7270/Q2MK6BVP
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Rattus norvegicus)	BDBM50014190 (2-Dimethylamino-5-phenylsulfanyl-hexa-2,4-dienedio...) Show SMILES CCOC(=O)C(Sc1ccccc1)=CC=C(N(C)C)C(=O)OCC Show InChI InChI=1S/C18H23NO4S/c1-5-22-17(20)15(19(3)4)12-13-16(18(21)23-6-2)24-14-10-8-7-9-11-14/h7-13H,5-6H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Recherches de Vitry Curated by ChEMBL					Assay Description In vitro inhibition of 5-lipoxygenase in rat (peritoneal assay)				J Med Chem 33: 2744-9 (1990) BindingDB Entry DOI: 10.7270/Q2MK6BVP
					More data for this Ligand-Target Pair