Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glyceraldehyde-3-phosphate dehydrogenase, cytosolic' and Ligand = 'BDBM50369051'   

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
Glyceraldehyde-3-phosphate dehydrogenase, cytosolic (Leishmania mexicana)	BDBM50369051 (CHEMBL609489) Show SMILES Nc1ncnc2n(cnc12)C1O[C@H](CNC(=O)C(c2ccccc2)c2ccccc2)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C24H24N6O4/c25-21-18-22(28-12-27-21)30(13-29-18)24-20(32)19(31)16(34-24)11-26-23(33)17(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,12-13,16-17,19-20,24,31-32H,11H2,(H,26,33)(H2,25,27,28)/t16-,19-,20-,24?/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Washington Curated by ChEMBL					Assay Description Inhibitory activity against Leishmania mexicana GAPDH				J Med Chem 44: 2080-93 (2001) BindingDB Entry DOI: 10.7270/Q2086604
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