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Target
Glyceraldehyde-3-phosphate dehydrogenase
Ligand
BDBM50216861
Substrate
n/a
Meas. Tech.
ChEMBL_440186 (CHEMBL890500)
IC50
15000±n/a nM
Citation
 Kim, H; Deng, L; Xiong, X; Hunter, WD; Long, MC; Pirrung, MC Glyceraldehyde 3-phosphate dehydrogenase is a cellular target of the insulin mimic demethylasterriquinone B1. J Med Chem 50:3423-6 (2007) [PubMed]  Article 
Target
Name:
Glyceraldehyde-3-phosphate dehydrogenase
Synonyms:
G3P_RABIT | GAPD | GAPDH
Type:
PROTEIN
Mol. Mass.:
35788.14
Organism:
Oryctolagus cuniculus
Description:
ChEMBL_980137
Residue:
333
Sequence:
MVKVGVNGFGRIGRLVTRAAFNSGKVDVVAINDPFIDLHYMVYMFQYDSTHGKFHGTVKAENGKLVINGKAITIFQERDPANIKWGDAGAEYVVESTGVFTTMEKAGAHLKGGAKRVIISAPSADAPMFVMGVNHEKYDNSLKIVSNASCTTNCLAPLAKVIHDHFGIVEGLMTTVHAITATQKTVDGPSGKLWRDGRGAAQNIIPASTGAAKAVGKVIPELNGKLTGMAFRVPTPNVSVVDLTCRLEKAAKYDDIKKVVKQASEGPLKGILGYTEDQVVSCDFNSATHSSTFDAGAGIALNDHFVKLISWYDNEFGYSNRVVDLMVHMASKE
  
Inhibitor
Name:
BDBM50216861
Synonyms:
2,5-dihydroxy-3-(7-(3-methylbut-2-enyl)-1H-indol-3-yl)-6-(2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl)cyclohexa-2,5-diene-1,4-dione | CHEMBL245012
Type:
Small organic molecule
Emp. Form.:
C32H30N2O4
Mol. Mass.:
506.5916
SMILES:
CC(C)=CCc1cccc2c(c[nH]c12)C1C(=O)C(=O)C(c2c([nH]c3ccccc23)C(C)(C)C=C)C(=O)C1=O |(10.47,-14.93,;9.15,-15.73,;9.19,-17.27,;7.8,-15,;6.48,-15.8,;6.54,-17.34,;8.04,-17.62,;8.56,-19.08,;7.56,-20.24,;6.05,-19.96,;4.83,-20.89,;3.56,-20.01,;4,-18.54,;5.54,-18.5,;4.86,-22.43,;6.18,-23.23,;7.53,-22.49,;6.15,-24.77,;7.46,-25.57,;4.8,-25.5,;4.76,-27.04,;5.94,-28.02,;5.37,-29.44,;3.84,-29.34,;2.75,-30.41,;1.27,-30,;.89,-28.51,;1.99,-27.44,;3.47,-27.85,;7.48,-28.01,;7.49,-29.55,;7.46,-26.47,;9.01,-27.99,;9.8,-29.31,;3.48,-24.72,;2.13,-25.46,;3.51,-23.18,;2.19,-22.39,)|
Structure:
Search PDB for entries with ligand similarity: