Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with Target = 'Polyunsaturated fatty acid 5-lipoxygenase' and Ligand = 'BDBM50008999'   

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))	BDBM50008999 (5-Methyl-2-[2-(naphthalen-2-yloxy)-ethyl]-2,4-dihy...) Show SMILES Cc1cc(=O)n(CCOc2ccc3ccccc3c2)[nH]1 Show InChI InChI=1S/C16H16N2O2/c1-12-10-16(19)18(17-12)8-9-20-15-7-6-13-4-2-3-5-14(13)11-15/h2-7,10-11,17H,8-9H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [14C]-arachidonic acid conversion to 5-HETE by broken cell 5-LO isolated from guinea pig PMN				Bioorg Med Chem Lett 2: 59-62 (1992) Article DOI: 10.1016/S0960-894X(00)80655-1 BindingDB Entry DOI: 10.7270/Q2FB52TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Rattus norvegicus)	BDBM50008999 (5-Methyl-2-[2-(naphthalen-2-yloxy)-ethyl]-2,4-dihy...) Show SMILES Cc1cc(=O)n(CCOc2ccc3ccccc3c2)[nH]1 Show InChI InChI=1S/C16H16N2O2/c1-12-10-16(19)18(17-12)8-9-20-15-7-6-13-4-2-3-5-14(13)11-15/h2-7,10-11,17H,8-9H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	2.50E+3	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)	BDBM50008999 (5-Methyl-2-[2-(naphthalen-2-yloxy)-ethyl]-2,4-dihy...) Show SMILES Cc1cc(=O)n(CCOc2ccc3ccccc3c2)[nH]1 Show InChI InChI=1S/C16H16N2O2/c1-12-10-16(19)18(17-12)8-9-20-15-7-6-13-4-2-3-5-14(13)11-15/h2-7,10-11,17H,8-9H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Molecular Therapeutics Inc. Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in rat RBL-1 cells				J Med Chem 33: 1163-70 (1990) BindingDB Entry DOI: 10.7270/Q2S75F9G
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Rattus norvegicus)	BDBM50008999 (5-Methyl-2-[2-(naphthalen-2-yloxy)-ethyl]-2,4-dihy...) Show SMILES Cc1cc(=O)n(CCOc2ccc3ccccc3c2)[nH]1 Show InChI InChI=1S/C16H16N2O2/c1-12-10-16(19)18(17-12)8-9-20-15-7-6-13-4-2-3-5-14(13)11-15/h2-7,10-11,17H,8-9H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.00E+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
Polyunsaturated fatty acid 5-lipoxygenase (Rattus norvegicus)	BDBM50008999 (5-Methyl-2-[2-(naphthalen-2-yloxy)-ethyl]-2,4-dihy...) Show SMILES Cc1cc(=O)n(CCOc2ccc3ccccc3c2)[nH]1 Show InChI InChI=1S/C16H16N2O2/c1-12-10-16(19)18(17-12)8-9-20-15-7-6-13-4-2-3-5-14(13)11-15/h2-7,10-11,17H,8-9H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
ICI Pharma Curated by ChEMBL					Assay Description In vitro inhibition of LTB4 production was measured in rat blood				J Med Chem 34: 1028-36 (1991) BindingDB Entry DOI: 10.7270/Q28G8MXH
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50008999 (5-Methyl-2-[2-(naphthalen-2-yloxy)-ethyl]-2,4-dihy...) Show SMILES Cc1cc(=O)n(CCOc2ccc3ccccc3c2)[nH]1 Show InChI InChI=1S/C16H16N2O2/c1-12-10-16(19)18(17-12)8-9-20-15-7-6-13-4-2-3-5-14(13)11-15/h2-7,10-11,17H,8-9H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	>3.72E+5	n/a	n/a	n/a	n/a
ICI Pharma Curated by ChEMBL					Assay Description Ex vivo inhibition of LTB4 production was measured in dog blood				J Med Chem 34: 1028-36 (1991) BindingDB Entry DOI: 10.7270/Q28G8MXH
					More data for this Ligand-Target Pair