Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetThymidine kinase
LigandBDBM50206507
Substrate/Competitorn/a
Meas. Tech.ChEMBL_454748 (CHEMBL886771)
IC50>500000±n/a nM
Citation Ciliberti, NManfredini, SAngusti, ADurini, ESolaroli, NVertuani, SBuzzoni, LBonache, MCBen-Shalom, EKarlsson, ASaada, ABalzarini, J Novel selective human mitochondrial kinase inhibitors: design, synthesis and enzymatic activity. Bioorg Med Chem15:3065-81 (2007) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Thymidine kinase
Name:Thymidine kinase
Synonyms:KITH_VZVD | TK
Type:PROTEIN
Mol. Mass.:37819.99
Organism:Varicella-zoster virus (strain Dumas) (HHV-3) (Human herpesvirus 3)
Description:ChEMBL_444706
Residue:341
Sequence:
MSTDKTDVKMGVLRIYLDGAYGIGKTTAAEEFLHHFAITPNRILLIGEPLSYWRNLAGED
AICGIYGTQTRRLNGDVSPEDAQRLTAHFQSLFCSPHAIMHAKISALMDTSTSDLVQVNK
EPYKIMLSDRHPIASTICFPLSRYLVGDMSPAALPGLLFTLPAEPPGTNLVVCTVSLPSH
LSRVSKRARPGETVNLPFVMVLRNVYIMLINTIIFLKTNNWHAGWNTLSFCNDVFKQKLQ
KSECIKLREVPGIEDTLFAVLKLPELCGEFGNILPLWAWGMETLSNCSRSMSPFVLSLEQ
TPQHAAQELKTLLPQMTPANMSSGAWNILKELVNAVQDNTS
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50206507
n/a
NameBDBM50206507
Synonyms:1-[2'-O-(N-Boc-12-aminododecanoyl)-beta-D-arabinofuranosyl]-5(E)-(2-bromovinyl)uracil | CHEMBL400232
TypeSmall organic molecule
Emp. Form.C28H44BrN3O9
Mol. Mass.646.568
SMILESCC(C)(C)OC(=O)NCCCCCCCCCCCC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cc(C=CBr)c(=O)[nH]c1=O |w:34.35|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: