Target
Glucose-6-phosphate 1-dehydrogenase
Ligand
BDBM50388499
Substrate
n/a
Meas. Tech.
ChEMBL_830110 (CHEMBL2061901)
IC50
70500±n/a nM
Citation
 Hamilton, NMDawson, MFairweather, EEHamilton, NSHitchin, JRJames, DIJones, SDJordan, AMLyons, AJSmall, HFThomson, GJWaddell, IDOgilvie, DJ Novel steroid inhibitors of glucose 6-phosphate dehydrogenase. J Med Chem 55:4431-45 (2012) [PubMed]  Article 
Target
Name:
Glucose-6-phosphate 1-dehydrogenase
Synonyms:
G6PD | G6PD_HUMAN | Glucose 6-phosphate dehydrogenase (G6PD) | Glucose-6-phosphate 1-dehydrogenase | glucose-6-phosphate 1-dehydrogenase isoform b
Type:
Enzyme
Mol. Mass.:
59258.58
Organism:
Homo sapiens (Human)
Description:
P11413
Residue:
515
Sequence:
MAEQVALSRTQVCGILREELFQGDAFHQSDTHIFIIMGASGDLAKKKIYPTIWWLFRDGLLPENTFIVGYARSRLTVADIRKQSEPFFKATPEEKLKLEDFFARNSYVAGQYDDAASYQRLNSHMNALHLGSQANRLFYLALPPTVYEAVTKNIHESCMSQIGWNRIIVEKPFGRDLQSSDRLSNHISSLFREDQIYRIDHYLGKEMVQNLMVLRFANRIFGPIWNRDNIACVILTFKEPFGTEGRGGYFDEFGIIRDVMQNHLLQMLCLVAMEKPASTNSDDVRDEKVKVLKCISEVQANNVVLGQYVGNPDGEGEATKGYLDDPTVPRGSTTATFAAVVLYVENERWDGVPFILRCGKALNERKAEVRLQFHDVAGDIFHQQCKRNELVIRVQPNEAVYTKMMTKKPGMFFNPEESELDLTYGNRYKNVKLPDAYERLILDVFCGSQMHFVRSDELREAWRIFTPLLHQIELEKPKPIPYIYGSRGPTEADELMKRVGFQYEGTYKWVNPHKL
  
Inhibitor
Name:
BDBM50388499
Synonyms:
CHEMBL2057298
Type:
Small organic molecule
Emp. Form.:
C21H35NO3S
Mol. Mass.:
381.573
SMILES:
CCS(=O)(=O)N[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@H]23)C1 |r|
Structure:
Search PDB for entries with ligand similarity: