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Target
Glyceraldehyde-3-phosphate dehydrogenase
Ligand
BDBM50068153
Substrate
n/a
Meas. Tech.
ChEMBL_72770 (CHEMBL681383)
IC50
5500±n/a nM
Citation
 Aronov, AM; Verlinde, CL; Hol, WG; Gelb, MH Selective tight binding inhibitors of trypanosomal glyceraldehyde-3-phosphate dehydrogenase via structure-based drug design. J Med Chem 41:4790-9 (1998) [PubMed]  Article 
Target
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:
MGKVKVGVNGFGRIGRLVTRAAFNSGKVDIVAINDPFIDLNYMVYMFQYDSTHGKFHGTVKAENGKLVINGNPITIFQERDPSKIKWGDAGAEYVVESTGVFTTMEKAGAHLQGGAKRVIISAPSADAPMFVMGVNHEKYDNSLKIISNASCTTNCLAPLAKVIHDNFGIVEGLMTTVHAITATQKTVDGPSGKLWRDGRGALQNIIPASTGAAKAVGKVIPELNGKLTGMAFRVPTANVSVVDLTCRLEKPAKYDDIKKVVKQASEGPLKGILGYTEHQVVSSDFNSDTHSSTFDAGAGIALNDHFVKLISWYDNEFGYSNRVVDLMAHMASKE
  
Inhibitor
Name:
BDBM50068153
Synonyms:
CHEMBL144953 | N-{2-[6-(2,3-Dimethyl-benzylamino)-purin-9-yl]-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-3-yl}-3-methoxy-benzamide
Type:
Small organic molecule
Emp. Form.:
C27H30N6O5
Mol. Mass.:
518.5643
SMILES:
COc1cccc(c1)C(=O)NC1C(O)C(CO)OC1n1cnc2c(NCc3cccc(C)c3C)ncnc12
Structure:
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