Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 541.6 BDBM50025867

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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
Lipoxygenase (Glycine max)	BDBM50025867 (CHEMBL3330912) Show SMILES [#6]-[#8]-c1ccc(cc1)-[#6](=[#7]\[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6](-[#6])-[#7]-c1cc(-[#8]-[#6])cc2cccnc12)\c1ccc(-[#8]-[#6])cc1 Show InChI InChI=1S/C31H35N5O4/c1-21(34-28-20-27(40-4)19-24-8-6-17-32-30(24)28)7-5-18-33-31(37)36-35-29(22-9-13-25(38-2)14-10-22)23-11-15-26(39-3)16-12-23/h6,8-17,19-21,34H,5,7,18H2,1-4H3,(H2,33,36,37)	UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Zagreb Curated by ChEMBL					Assay Description Inhibition of soybean LOX using sodium linoleate as substrate by spectrophotometry				Eur J Med Chem 86: 502-14 (2014) Article DOI: 10.1016/j.ejmech.2014.09.013 BindingDB Entry DOI: 10.7270/Q2Z89F0V
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