Target
Sorbitol dehydrogenase
Ligand
BDBM50108764
Substrate
n/a
Meas. Tech.
ChEMBL_201003 (CHEMBL801253)
IC50
140±n/a nM
Citation
 Chu-Moyer, MYBallinger, WEBeebe, DABerger, RCoutcher, JBDay, WWLi, JMylari, BLOates, PJWeekly, RM Orally-effective, long-acting sorbitol dehydrogenase inhibitors: synthesis, structure-activity relationships, and in vivo evaluations of novel heterocycle-substituted piperazino-pyrimidines. J Med Chem 45:511-28 (2002) [PubMed]  Article 
Target
Name:
Sorbitol dehydrogenase
Synonyms:
DHSO_HUMAN | L-iditol 2-dehydrogenase | SORD
Type:
PROTEIN
Mol. Mass.:
38332.20
Organism:
Homo sapiens (Human)
Description:
ChEMBL_223910
Residue:
357
Sequence:
MAAAAKPNNLSLVVHGPGDLRLENYPIPEPGPNEVLLRMHSVGICGSDVHYWEYGRIGNFIVKKPMVLGHEASGTVEKVGSSVKHLKPGDRVAIEPGAPRENDEFCKMGRYNLSPSIFFCATPPDDGNLCRFYKHNAAFCYKLPDNVTFEEGALIEPLSVGIHACRRGGVTLGHKVLVCGAGPIGMVTLLVAKAMGAAQVVVTDLSATRLSKAKEIGADLVLQISKESPQEIARKVEGQLGCKPEVTIECTGAEASIQAGIYATRSGGNLVLVGLGSEMTTVPLLHAAIREVDIKGVFRYCNTWPVAISMLASKSVNVKPLVTHRFPLEKALEAFETFKKGLGLKIMLKCDPSDQNP
  
Inhibitor
Name:
BDBM50108764
Synonyms:
1-{4-[4-(4-Hydroxymethyl-6-methyl-pyrimidin-2-yl)-3-methyl-piperazin-1-yl]-pyrimidin-2-yl}-ethanol | CHEMBL148936
Type:
Small organic molecule
Emp. Form.:
C17H24N6O2
Mol. Mass.:
344.4115
SMILES:
C[C@@H](O)c1nccc(n1)N1CCN([C@H](C)C1)c1nc(C)cc(CO)n1
Structure:
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