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TargetGlyceraldehyde-3-phosphate dehydrogenase
LigandBDBM50096597
Substrate/Competitorn/a
Meas. Tech.ChEMBL_69913 (CHEMBL682263)
IC50 60±n/a nM
Citation Kennedy, KJBressi, JCGelb, MH A disubstituted NAD+ analogue is a nanomolar inhibitor of trypanosomal glyceraldehyde-3-phosphate dehydrogenase. Bioorg Med Chem Lett11:95-8 (2001) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Glyceraldehyde-3-phosphate dehydrogenase
Name:Glyceraldehyde-3-phosphate dehydrogenase
Synonyms:G3P_HUMAN | GAPD | GAPDH | Glyceraldehyde-3-phosphate dehydrogenase liver | glyceraldehyde-3-phosphate dehydrogenase
Type:PROTEIN
Mol. Mass.:36060.86
Organism:Homo sapiens (Human)
Description:ChEMBL_1511315
Residue:335
Sequence:
MGKVKVGVNGFGRIGRLVTRAAFNSGKVDIVAINDPFIDLNYMVYMFQYDSTHGKFHGTV
KAENGKLVINGNPITIFQERDPSKIKWGDAGAEYVVESTGVFTTMEKAGAHLQGGAKRVI
ISAPSADAPMFVMGVNHEKYDNSLKIISNASCTTNCLAPLAKVIHDNFGIVEGLMTTVHA
ITATQKTVDGPSGKLWRDGRGALQNIIPASTGAAKAVGKVIPELNGKLTGMAFRVPTANV
SVVDLTCRLEKPAKYDDIKKVVKQASEGPLKGILGYTEHQVVSSDFNSDTHSSTFDAGAG
IALNDHFVKLISWYDNEFGYSNRVVDLMAHMASKE
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50096597
n/a
NameBDBM50096597
Synonyms:CHEMBL3350919 | NAD+ analogue
TypeSmall organic molecule
Emp. Form.C39H40N8O15P2
Mol. Mass.922.727
SMILESCOc1cccc(c1)C(=O)N[C@@H]1[C@H](O)[C@@H](COP(O)(=O)OP([O-])(=O)O[C@H]2O[C@H]([C@H](O)[C@@H]2O)[n+]2cccc(c2)C(N)=O)O[C@H]1n1cnc2c(NCc3cccc4ccccc34)ncnc12
Structure
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