Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dihydrofolate reductase' and Ligand = 'BDBM226167'   

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
Dihydrofolate reductase (Bos taurus (Cattle))	BDBM226167 (N'-[4-Methoxybenzylidene-2-(6,7-dimethoxy)-3-(...) Show SMILES COc1ccc(\C=N\NC(=O)CSc2nc3cc(OC)c(OC)cc3c(=O)n2-c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C27H26N4O6S/c1-34-19-9-5-17(6-10-19)15-28-30-25(32)16-38-27-29-22-14-24(37-4)23(36-3)13-21(22)26(33)31(27)18-7-11-20(35-2)12-8-18/h5-15H,16H2,1-4H3,(H,30,32)/b28-15+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	7.4	25
Future University					Assay Description The assay mixture contained 50 μM Tris-HCl buffer (pH 7.4), 50 μM NADPH, 10 μl DMSO or the same volume of DMSO solution containing the...				Bioorg Chem 72: 282-292 (2017) BindingDB Entry DOI: 10.7270/Q2TX3D82
					More data for this Ligand-Target Pair