Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Polyunsaturated fatty acid 5-lipoxygenase' and Ligand = 'BDBM50341253'   

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))	BDBM50341253 (5-(3-chlorobenzylidene)-2-p-tolylthiazol-4(5H)-one...) Show SMILES Cc1ccc(cc1)C1=NC(=O)\C(S1)=C\c1cccc(Cl)c1 |t:8| Show InChI InChI=1S/C17H12ClNOS/c1-11-5-7-13(8-6-11)17-19-16(20)15(21-17)10-12-3-2-4-14(18)9-12/h2-10H,1H3/b15-10-	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	300	n/a	n/a	n/a	n/a	n/a	n/a
Goethe University Frankfurt Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in S100 supernatant assessed as inhibition of LTB4 production preincubated for 15 mins measured after 10 mins by HPLC me...				J Med Chem 54: 1943-7 (2011) Checked by Author Article DOI: 10.1021/jm101165z BindingDB Entry DOI: 10.7270/Q23T9J70
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50341253 (5-(3-chlorobenzylidene)-2-p-tolylthiazol-4(5H)-one...) Show SMILES Cc1ccc(cc1)C1=NC(=O)\C(S1)=C\c1cccc(Cl)c1 |t:8| Show InChI InChI=1S/C17H12ClNOS/c1-11-5-7-13(8-6-11)17-19-16(20)15(21-17)10-12-3-2-4-14(18)9-12/h2-10H,1H3/b15-10-	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	300	n/a	n/a	n/a	n/a	n/a	n/a
Goethe University Frankfurt Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in S100 supernatant assessed as inhibition of (5(S)-hydroperoxy-6-trans-8,11,14-cis-eicosatetraenoic acid production pre...				J Med Chem 54: 1943-7 (2011) Checked by Author Article DOI: 10.1021/jm101165z BindingDB Entry DOI: 10.7270/Q23T9J70
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50341253 (5-(3-chlorobenzylidene)-2-p-tolylthiazol-4(5H)-one...) Show SMILES Cc1ccc(cc1)C1=NC(=O)\C(S1)=C\c1cccc(Cl)c1 |t:8| Show InChI InChI=1S/C17H12ClNOS/c1-11-5-7-13(8-6-11)17-19-16(20)15(21-17)10-12-3-2-4-14(18)9-12/h2-10H,1H3/b15-10-	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	580	n/a	n/a	n/a	n/a	n/a	n/a
Goethe University Frankfurt Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production preincubated for 15 mins measured after ...				J Med Chem 54: 1943-7 (2011) Checked by Author Article DOI: 10.1021/jm101165z BindingDB Entry DOI: 10.7270/Q23T9J70
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50341253 (5-(3-chlorobenzylidene)-2-p-tolylthiazol-4(5H)-one...) Show SMILES Cc1ccc(cc1)C1=NC(=O)\C(S1)=C\c1cccc(Cl)c1 |t:8| Show InChI InChI=1S/C17H12ClNOS/c1-11-5-7-13(8-6-11)17-19-16(20)15(21-17)10-12-3-2-4-14(18)9-12/h2-10H,1H3/b15-10-	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	580	n/a	n/a	n/a	n/a	n/a	n/a
Goethe University Frankfurt Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as inhibition of (5(S)-hydroperoxy-6-trans-8,11,14-cis-eicosatetraenoic a...				J Med Chem 54: 1943-7 (2011) Checked by Author Article DOI: 10.1021/jm101165z BindingDB Entry DOI: 10.7270/Q23T9J70
					More data for this Ligand-Target Pair