Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Seed linoleate 13S-lipoxygenase-1' and Ligand = 'BDBM50225144'   

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))	BDBM50225144 (6-fluoro-2-methyl-3-[5-(3,4,5-trimethoxy-phenyl)-4...) Show SMILES COc1cc(cc(OC)c1OC)C1C[C-](N=[NH+]1)c1c(C)[n+]([O-])c2ccc(F)cc2[n+]1[O-] |c:16| Show InChI InChI=1S/C21H20FN4O5/c1-11-20(26(28)17-9-13(22)5-6-16(17)25(11)27)15-10-14(23-24-15)12-7-18(29-2)21(31-4)19(8-12)30-3/h5-9,14H,10H2,1-4H3/q-1/p+1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Navarra Curated by ChEMBL					Assay Description Inhibition of soybean lipoxygenase				Bioorg Med Chem Lett 17: 6439-43 (2007) Article DOI: 10.1016/j.bmcl.2007.10.002 BindingDB Entry DOI: 10.7270/Q2XW4JJ8
					More data for this Ligand-Target Pair