Reaction Details Report a problem with these data
Target
Thymidine kinase, cytosolic
Ligand
BDBM50367095
Substrate
n/a
Meas. Tech.
ChEMBL_123828 (CHEMBL734266)
Ki
5000±n/a nM
Citation
 Hampton, A; Hai, TT; Kappler, F; Chawla, RR Species- or isozyme-specific enzyme inhibitors. 6. Synthesis and evaluation of two-substrate condensation products as inhibitors of hexokinases and thymidine kinases. J Med Chem 25:801-5 (1982) [PubMed]  Article 
Target
Name:
Thymidine kinase, cytosolic
Synonyms:
KITH_RAT | Thymidine kinase | Tk-1 | Tk1
Type:
PROTEIN
Mol. Mass.:
13514.16
Organism:
Rattus norvegicus
Description:
ChEMBL_208200
Residue:
121
Sequence:
MSYINLPTVLPISPSKTRGQIQVILGPMFSGKSTELMRRVRRFQIAQYKCLVIKYAKDTRYSNSFSTHDRNTMDALPACMLKDVAQEALGVAVIGIDEGQFFPDIVDFCETMANTGKTVIV
  
Inhibitor
Name:
BDBM50367095
Synonyms:
CHEMBL607917
Type:
Small organic molecule
Emp. Form.:
C20H28N7O17P3
Mol. Mass.:
731.3943
SMILES:
Nc1ncnc2n(cnc12)C1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)Cc2cn(C3C[C@H](O)[C@@H](CO)O3)c(=O)[nH]c2=O)[C@@H](O)[C@H]1O |r|
Structure:
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