Target
Inositol hexakisphosphate kinase 3
Ligand
BDBM373532
Substrate
n/a
Meas. Tech.
ChEMBL_2251836 (CHEMBL5166046)
IC50
3080±n/a nM
Citation
 Zhou, YMukherjee, SHuang, DChakraborty, MGu, CZong, GStashko, MAPearce, KHShears, SBChakraborty, AWang, HWang, X Development of Novel IP6K Inhibitors for the Treatment of Obesity and Obesity-Induced Metabolic Dysfunctions. J Med Chem 65:6869-6887 (2022) [PubMed] 
Target
Name:
Inositol hexakisphosphate kinase 3
Synonyms:
2.7.4.21 | IHPK3 | IP6K3 | IP6K3_HUMAN | Inositol hexakisphosphate kinase 3 | Inositol hexaphosphate kinase 3 | InsP6 kinase 3
Type:
PROTEIN
Mol. Mass.:
46429.62
Organism:
Homo sapiens
Description:
ChEMBL_119181
Residue:
410
Sequence:
MVVQNSADAGDMRAGVQLEPFLHQVGGHMSVMKYDEHTVCKPLVSREQRFYESLPLAMKRFTPQYKGTVTVHLWKDSTGHLSLVANPVKESQEPFKVSTESAAVAIWQTLQQTTGSNGSDCTLAQWPHAQLARSPKESPAKALLRSEPHLNTPAFSLVEDTNGNQVERKSFNPWGLQCHQAHLTRLCSEYPENKRHRFLLLENVVSQYTHPCVLDLKMGTRQHGDDASEEKKARHMRKCAQSTSACLGVRICGMQVYQTDKKYFLCKDKYYGRKLSVEGFRQALYQFLHNGSHLRRELLEPILHQLRALLSVIRSQSSYRFYSSSLLVIYDGQEPPERAPGSPHPHEAPQAAHGSSPGGLTKVDIRMIDFAHTTYKGYWNEHTTYDGPDPGYIFGLENLIRILQDIQEGE
  
Inhibitor
Name:
BDBM373532
Synonyms:
US9903855, Molecule 1
Type:
Small organic molecule
Emp. Form.:
C16H11NO3
Mol. Mass.:
265.2634
SMILES:
OC(=O)\C=C\c1ccc2c(onc2c1)-c1ccccc1
Structure:
Search PDB for entries with ligand similarity: