Reaction Details Report a problem with these data
Target
Thymidine kinase, cytosolic
Ligand
BDBM50317622
Substrate
n/a
Meas. Tech.
ChEMBL_632888 (CHEMBL1107470)
IC50
105000±n/a nM
Citation
 Lin, J; Roy, V; Wang, L; You, L; Agrofoglio, LA; Deville-Bonne, D; McBrayer, TR; Coats, SJ; Schinazi, RF; Eriksson, S 3'-(1,2,3-Triazol-1-yl)-3'-deoxythymidine analogs as substrates for human and Ureaplasma parvum thymidine kinase for structure-activity investigations. Bioorg Med Chem 18:3261-9 (2010) [PubMed]  Article 
Target
Name:
Thymidine kinase, cytosolic
Synonyms:
KITH_HUMAN | TK1
Type:
PROTEIN
Mol. Mass.:
25476.50
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1333884
Residue:
234
Sequence:
MSCINLPTVLPGSPSKTRGQIQVILGPMFSGKSTELMRRVRRFQIAQYKCLVIKYAKDTRYSSSFCTHDRNTMEALPACLLRDVAQEALGVAVIGIDEGQFFPDIVEFCEAMANAGKTVIVAALDGTFQRKPFGAILNLVPLAESVVKLTAVCMECFREAAYTKRLGTEKEVEVIGGADKYHSVCRLCYFKKASGQPAGPDNKENCPVPGKPGEAVAARKLFAPQQILQCSPAN
  
Inhibitor
Name:
BDBM50317622
Synonyms:
3'-(4-(3-Chloro-propyl)-1,2,3-triazol-1-yl)-3'-deoxythymidine | CHEMBL1098660
Type:
Small organic molecule
Emp. Form.:
C15H21N5O4
Mol. Mass.:
335.3583
SMILES:
CCCc1cn(nn1)[C@H]1C[C@@H](O[C@@H]1CO)n1cc(C)c(=O)[nH]c1=O |r|
Structure:
Search PDB for entries with ligand similarity: