Reaction Details Report a problem with these data
Target
Bifunctional phosphoribosylaminoimidazole carboxylase/phosphoribosylaminoimidazole succinocarboxamide synthetase
Ligand
BDBM488654
Substrate
n/a
Meas. Tech.
Biochemical Assay
IC50
17.5±n/a nM
Citation
 Osborne, S; Large, J Oxazole derivatives for use in the treatment of cancer US Patent  US10961233 Publication Date 3/30/2021 
Target
Name:
Bifunctional phosphoribosylaminoimidazole carboxylase/phosphoribosylaminoimidazole succinocarboxamide synthetase
Synonyms:
ADE2 | AIRC | Multifunctional protein ADE2 | PAICS | PAIS | PUR6_HUMAN
Type:
Protein
Mol. Mass.:
47081.21
Organism:
Human
Description:
P22234
Residue:
425
Sequence:
MATAEVLNIGKKLYEGKTKEVYELLDSPGKVLLQSKDQITAGNAARKNHLEGKAAISNKITSCIFQLLQEAGIKTAFTRKCGETAFIAPQCEMIPIEWVCRRIATGSFLKRNPGVKEGYKFYPPKVELFFKDDANNDPQWSEEQLIAAKFCFAGLLIGQTEVDIMSHATQAIFEILEKSWLPQNCTLVDMKIEFGVDVTTKEIVLADVIDNDSWRLWPSGDRSQQKDKQSYRDLKEVTPEGLQMVKKNFEWVAERVELLLKSESQCRVVVLMGSTSDLGHCEKIKKACGNFGIPCELRVTSAHKGPDETLRIKAEYEGDGIPTVFVAVAGRSNGLGPVMSGNTAYPVISCPPLTPDWGVQDVWSSLRLPSGLGCSTVLSPEGSAQFAAQIFGLSNHLVWSKLRASILNTWISLKQADKKIRECNL
  
Inhibitor
Name:
BDBM488654
Synonyms:
US10961233, Example 20
Type:
Small organic molecule
Emp. Form.:
C20H25ClN6O4
Mol. Mass.:
448.903
SMILES:
CN1CC(COC(=O)N2CCN(CC2)c2ccc(Cl)c(NC(=O)c3coc(N)n3)c2)C1
Structure:
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