BDBM50446417 CHEMBL3109716

SMILES: OC(=O)c1ccc2cc(CC3=CC(=O)C(=O)CC3=O)ccc2c1

InChI Key: InChIKey=ZFDWRRHHBQOVFD-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 = 50446417   

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))	BDBM50446417 (CHEMBL3109716) Show SMILES OC(=O)c1ccc2cc(CC3=CC(=O)C(=O)CC3=O)ccc2c1 |t:10| Show InChI InChI=1S/C18H12O5/c19-15-9-17(21)16(20)8-14(15)6-10-1-2-12-7-13(18(22)23)4-3-11(12)5-10/h1-5,7-8H,6,9H2,(H,22,23)	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	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Salerno Curated by ChEMBL					Assay Description Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate after 10 mins				Eur J Med Chem 67: 269-79 (2013) Article DOI: 10.1016/j.ejmech.2013.06.039 BindingDB Entry DOI: 10.7270/Q2XW4M9Z
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50446417 (CHEMBL3109716) Show SMILES OC(=O)c1ccc2cc(CC3=CC(=O)C(=O)CC3=O)ccc2c1 |t:10| Show InChI InChI=1S/C18H12O5/c19-15-9-17(21)16(20)8-14(15)6-10-1-2-12-7-13(18(22)23)4-3-11(12)5-10/h1-5,7-8H,6,9H2,(H,22,23)	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	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Salerno Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL using arachidonic acid as substrate preincubated for 15 mins				Eur J Med Chem 67: 269-79 (2013) Article DOI: 10.1016/j.ejmech.2013.06.039 BindingDB Entry DOI: 10.7270/Q2XW4M9Z
					More data for this Ligand-Target Pair