Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Seed linoleate 13S-lipoxygenase-1' and Ligand = 'BDBM235667'   

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
Seed linoleate 13S-lipoxygenase-1 (Glycine max (soybean))	BDBM235667 (8,11-Dihydro-2H-oxepino[2,3-h]chromen-2-one (7a)) Show SMILES O=c1ccc2ccc3OCC=CCc3c2o1 |c:10| Show InChI InChI=1S/C13H10O3/c14-12-7-5-9-4-6-11-10(13(9)16-12)3-1-2-8-15-11/h1-2,4-7H,3,8H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.10E+5	n/a	n/a	n/a	n/a	n/a	25
Aristotle University of Thessaloniki					Assay Description In vitro study was evaluated as reported previously [Symeonidis et al., Bioorg. Med. Chem. Lett., 19:1139-1142]. The tested compounds dissolved in et...				J Enzyme Inhib Med Chem 26: 805-12 (2011) Article DOI: 10.3109/14756366.2011.555944 BindingDB Entry DOI: 10.7270/Q2WS8S5D
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