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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 = 'BDBM50100502'   
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)		BDBM50100502
PNG
(CHEMBL63304 | N-(4-Hydroxy-5-hydroxymethyl-2-{6-[2...)
Show SMILES COc1cc(OC)cc(c1)C(=O)N[C@@H]1C(Cn2cnc3c(NCc4ccccc4Sc4ccccc4CO)ncnc23)OC(CO)[C@@H]1O
Show InChI InChI=1S/C34H36N6O7S/c1-45-23-11-22(12-24(13-23)46-2)34(44)39-29-25(47-26(17-42)31(29)43)15-40-19-38-30-32(36-18-37-33(30)40)35-14-20-7-3-5-9-27(20)48-28-10-6-4-8-21(28)16-41/h3-13,18-19,25-26,29,31,41-43H,14-17H2,1-2H3,(H,39,44)(H,35,36,37)/t25?,26?,29-,31+/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 7.50E+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