BDBM50041807 4-(1,8-Dihydroxy-9-oxo-9,10-dihydro-anthracen-2-ylmethyl)-benzoic acid methyl ester::CHEMBL44843

SMILES: COC(=O)c1ccc(Cc2ccc3Cc4cccc(O)c4C(=O)c3c2O)cc1

InChI Key: InChIKey=JOUYFNVTNGRAQQ-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 = 50041807   

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 (Bos taurus)	BDBM50041807 (4-(1,8-Dihydroxy-9-oxo-9,10-dihydro-anthracen-2-yl...) Show SMILES COC(=O)c1ccc(Cc2ccc3Cc4cccc(O)c4C(=O)c3c2O)cc1 Show InChI InChI=1S/C23H18O5/c1-28-23(27)14-7-5-13(6-8-14)11-17-10-9-16-12-15-3-2-4-18(24)19(15)22(26)20(16)21(17)25/h2-10,24-25H,11-12H2,1H3	PDB MMDB Reactome pathway UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Westfälische Wilhelms-Universität Münster Curated by ChEMBL					Assay Description 5-LO inhibitory activity, measured by production of 5-hydroxyeicosatetraenoic acid (5-HETE) and leukotriene B4 (LTB4) in bovine polymorphonuclear leu...				J Med Chem 40: 2780-7 (1997) Article DOI: 10.1021/jm9701785 BindingDB Entry DOI: 10.7270/Q28C9VB4
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Bos taurus)	BDBM50041807 (4-(1,8-Dihydroxy-9-oxo-9,10-dihydro-anthracen-2-yl...) Show SMILES COC(=O)c1ccc(Cc2ccc3Cc4cccc(O)c4C(=O)c3c2O)cc1 Show InChI InChI=1S/C23H18O5/c1-28-23(27)14-7-5-13(6-8-14)11-17-10-9-16-12-15-3-2-4-18(24)19(15)22(26)20(16)21(17)25/h2-10,24-25H,11-12H2,1H3	PDB MMDB Reactome pathway UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universität Regensburg Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in bovine polymorphonuclear leukocytes				J Med Chem 37: 1660-9 (1994) BindingDB Entry DOI: 10.7270/Q2H70DW9
					More data for this Ligand-Target Pair