Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 335.5 BDBM50451428

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)	BDBM50451428 (CHEMBL4218768) Show SMILES CC(C)(C)c1cc(\C=C\C(=O)NCCS)cc(c1O)C(C)(C)C Show InChI InChI=1S/C19H29NO2S/c1-18(2,3)14-11-13(7-8-16(21)20-9-10-23)12-15(17(14)22)19(4,5)6/h7-8,11-12,22-23H,9-10H2,1-6H3,(H,20,21)/b8-7+	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
Aristotelian University of Thessaloniki Curated by ChEMBL					Assay Description Inhibition of soybean lipoxygenase using sodium linoleate as substrate measured after 7 mins				Bioorg Med Chem Lett 27: 4800-4804 (2017) Article DOI: 10.1016/j.bmcl.2017.09.054 BindingDB Entry DOI: 10.7270/Q29G5QCR
					More data for this Ligand-Target Pair