Reaction Details  Report a problem with these data
Target
Fructose-bisphosphate aldolase A
Ligand
BDBM50364830
Substrate
n/a
Meas. Tech.
ChEMBL_803281 (CHEMBL1955106)
Ki
500000±n/a nM
Citation
 Desvergnes, S; Courtiol-Legourd, S; Daher, R; Dabrowski, M; Salmon, L; Therisod, M Synthesis and evaluation of malonate-based inhibitors of phosphosugar-metabolizing enzymes: class II fructose-1,6-bis-phosphate aldolases, type I phosphomannose isomerase, and phosphoglucose isomerase. Bioorg Med Chem 20:1511-20 (2012) [PubMed]  Article
Target
Name:
Fructose-bisphosphate aldolase A
Synonyms:
ALDOA | ALDOA_RABIT
Type:
PROTEIN
Mol. Mass.:
39351.00
Organism:
Oryctolagus cuniculus
Description:
ChEMBL_813854
Residue:
364
Sequence:
MPHSHPALTPEQKKELSDIAHRIVAPGKGILAADESTGSIAKRLQSIGTENTEENRRFYRQLLLTADDRVNPCIGGVILFHETLYQKADDGRPFPQVIKSKGGVVGIKVDKGVVPLAGTNGETTTQGLDGLSERCAQYKKDGADFAKWRCVLKIGEHTPSALAIMENANVLARYASICQQNGIVPIVEPEILPDGDHDLKRCQYVTEKVLAAVYKALSDHHIYLEGTLLKPNMVTPGHACTQKYSHEEIAMATVTALRRTVPPAVTGVTFLSGGQSEEEASINLNAINKCPLLKPWALTFSYGRALQASALKAWGGKKENLKAAQEEYVKRALANSLACQGKYTPSGQAGAAASESLFISNHAY
  
Inhibitor
Name:
BDBM50364830
Synonyms:
CHEMBL1952348
Type:
Small organic molecule
Emp. Form.:
C9H14NO10P
Mol. Mass.:
327.183
SMILES:
ON(CCCCOP(O)([O-])=O)C(=O)CC(C(O)=O)C([O-])=O
Structure:
Search PDB for entries with ligand similarity: