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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glyceraldehyde-3-phosphate dehydrogenase, cytosolic' and Ligand = 'BDBM50100478'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Glyceraldehyde-3-phosphate dehydrogenase, cytosolic


(Leishmania mexicana)		BDBM50100478
PNG
(3-Dimethylamino-N-(4-hydroxy-5-hydroxymethyl-2-{6-...)
Show SMILES CN(C)c1cccc(c1)C(=O)N[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NCc3cccc4ccccc34)ncnc12
Show InChI InChI=1S/C30H31N7O4/c1-36(2)21-11-6-9-19(13-21)29(40)35-24-26(39)23(15-38)41-30(24)37-17-34-25-27(32-16-33-28(25)37)31-14-20-10-5-8-18-7-3-4-12-22(18)20/h3-13,16-17,23-24,26,30,38-39H,14-15H2,1-2H3,(H,35,40)(H,31,32,33)/t23-,24-,26-,30-/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 2.50E+4n/an/an/an/an/an/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
More data for this
Ligand-Target Pair