Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dihydrofolate reductase' and Ligand = 'BDBM226166'   

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))	BDBM226166 (N'-[4-Chlorobenzylidene-2-(6,7-dimethoxy)-3-(4...) Show SMILES COc1ccc(cc1)-n1c(SCC(=O)N\N=C\c2ccc(Cl)cc2)nc2cc(OC)c(OC)cc2c1=O Show InChI InChI=1S/C26H23ClN4O5S/c1-34-19-10-8-18(9-11-19)31-25(33)20-12-22(35-2)23(36-3)13-21(20)29-26(31)37-15-24(32)30-28-14-16-4-6-17(27)7-5-16/h4-14H,15H2,1-3H3,(H,30,32)/b28-14+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	7.60E+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