Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thioredoxin glutathione reductase' and Ligand = 'BDBM35361'   

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
Thioredoxin glutathione reductase (Schistosoma mansoni)	BDBM35361 ((5-oxidanidyl-4-thiophen-2-ylcarbonyl-1,2,5-oxadia...) Show SMILES [O-]n1[o+]nc(C(=O)c2cccs2)c1C(=O)c1cccs1 Show InChI InChI=1S/C12H6N2O4S2/c15-11(7-3-1-5-19-7)9-10(14(17)18-13-9)12(16)8-4-2-6-20-8/h1-6H	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
National Human Genome Research Institute Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni TGR				J Med Chem 52: 6474-83 (2009) Article DOI: 10.1021/jm901021k BindingDB Entry DOI: 10.7270/Q2TH8MS1
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