Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Triosephosphate isomerase, glycosomal' and Ligand = 'BDBM50332792'   

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
Triosephosphate isomerase, glycosomal (Trypanosoma cruzi)	BDBM50332792 (4-(5-Nitro-furan-2-ylmethylene)-1,1-dioxo-1,4-dihy...) Show SMILES NC1=NS(=O)(=O)NC(=N)C1=Cc1ccc(o1)[N+]([O-])=O |w:10.11,t:1| Show InChI InChI=1S/C8H7N5O5S/c9-7-5(8(10)12-19(16,17)11-7)3-4-1-2-6(18-4)13(14)15/h1-3H,(H2,9,11)(H2,10,12)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de la Rep£blica Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi triosephosphate isomerase after 2 hrs				Eur J Med Chem 45: 5767-72 (2010) Article DOI: 10.1016/j.ejmech.2010.09.034 BindingDB Entry DOI: 10.7270/Q2QN6719
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