Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Trans-sialidase' and Ligand = 'BDBM50266703'   

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
Trans-sialidase (Trypanosoma cruzi)	BDBM50266703 (ethyl (3S,4R,5R)-4-acetamido-3-hydroxy-5-(2-hydrox...) Show SMILES CCOP([O-])(=O)C1=C[C@H](O)[C@@H](NC(C)=O)[C@@H](C1)OCCO |r,t:6| Show InChI InChI=1S/C12H22NO7P/c1-3-20-21(17,18)9-6-10(16)12(13-8(2)15)11(7-9)19-5-4-14/h6,10-12,14,16H,3-5,7H2,1-2H3,(H,13,15)(H,17,18)/p-1/t10-,11+,12+/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi trans-Sialidase				Bioorg Med Chem Lett 19: 589-96 (2009) Article DOI: 10.1016/j.bmcl.2008.12.065 BindingDB Entry DOI: 10.7270/Q2X92C7J
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