BDBM50341269 (Z)-2-(4-Chlorophenyl)-5-(4-methoxybenzylidene)-5H-thiazol-4-one::CHEMBL1765899

SMILES: COc1ccc(\C=C2/SC(=NC2=O)c2ccc(Cl)cc2)cc1

InChI Key: InChIKey=BYPSEBXZQCBFIP-GDNBJRDFSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50341269   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50341269 ((Z)-2-(4-Chlorophenyl)-5-(4-methoxybenzylidene)-5H...) Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(Cl)cc2)cc1 |c:9| Show InChI InChI=1S/C17H12ClNO2S/c1-21-14-8-2-11(3-9-14)10-15-16(20)19-17(22-15)12-4-6-13(18)7-5-12/h2-10H,1H3/b15-10-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	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
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50341269 ((Z)-2-(4-Chlorophenyl)-5-(4-methoxybenzylidene)-5H...) Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(Cl)cc2)cc1 |c:9| Show InChI InChI=1S/C17H12ClNO2S/c1-21-14-8-2-11(3-9-14)10-15-16(20)19-17(22-15)12-4-6-13(18)7-5-12/h2-10H,1H3/b15-10-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90	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
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50341269 ((Z)-2-(4-Chlorophenyl)-5-(4-methoxybenzylidene)-5H...) Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(Cl)cc2)cc1 |c:9| Show InChI InChI=1S/C17H12ClNO2S/c1-21-14-8-2-11(3-9-14)10-15-16(20)19-17(22-15)12-4-6-13(18)7-5-12/h2-10H,1H3/b15-10-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90	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
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50341269 ((Z)-2-(4-Chlorophenyl)-5-(4-methoxybenzylidene)-5H...) Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(Cl)cc2)cc1 |c:9| Show InChI InChI=1S/C17H12ClNO2S/c1-21-14-8-2-11(3-9-14)10-15-16(20)19-17(22-15)12-4-6-13(18)7-5-12/h2-10H,1H3/b15-10-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	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