BDBM50038460 CHEMBL3353726

SMILES: COc1ccc(cc1)-c1sc(nc1O)-c1ccc(Cl)cc1

InChI Key: InChIKey=CUHJHZKKCKDGCX-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50038460   

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))	BDBM50038460 (CHEMBL3353726) Show SMILES COc1ccc(cc1)-c1sc(nc1O)-c1ccc(Cl)cc1 Show InChI InChI=1S/C16H12ClNO2S/c1-20-13-8-4-10(5-9-13)14-15(19)18-16(21-14)11-2-6-12(17)7-3-11/h2-9,19H,1H3	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	50	n/a	n/a	n/a	n/a	n/a	n/a
Goethe-University Frankfurt Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL S100 extract using arachidonic acid as substrate incubated for 15 mins prior to substrate addition measured after 10...				Eur J Med Chem 89: 503-23 (2014) Article DOI: 10.1016/j.ejmech.2014.10.054 BindingDB Entry DOI: 10.7270/Q2959K5T
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50038460 (CHEMBL3353726) Show SMILES COc1ccc(cc1)-c1sc(nc1O)-c1ccc(Cl)cc1 Show InChI InChI=1S/C16H12ClNO2S/c1-20-13-8-4-10(5-9-13)14-15(19)18-16(21-14)11-2-6-12(17)7-3-11/h2-9,19H,1H3	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	10	n/a	n/a	n/a	n/a	n/a	n/a
Goethe-University Frankfurt Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL using arachidonic acid as substrate assessed as product formation incubated for 15 mins prior to substrate addition ...				Eur J Med Chem 89: 503-23 (2014) Article DOI: 10.1016/j.ejmech.2014.10.054 BindingDB Entry DOI: 10.7270/Q2959K5T
					More data for this Ligand-Target Pair