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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thymidine phosphorylase' and Ligand = 'BDBM50378684'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thymidine phosphorylase


(Rattus norvegicus)
BDBM50378684
PNG
(CHEMBL599543)
Show SMILES Cc1cn([C@H]2C[C@H](CO)N(C2)C(=O)P(O)(O)=O)c(=O)[nH]c1=O |r|
Show InChI InChI=1S/C11H16N3O7P/c1-6-3-13(10(17)12-9(6)16)7-2-8(5-15)14(4-7)11(18)22(19,20)21/h3,7-8,15H,2,4-5H2,1H3,(H,12,16,17)(H2,19,20,21)/t7-,8+/m0/s1
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Similars

Article
PubMed
n/an/a 45n/an/an/an/an/an/a



Academy of Sciences of the Czech Republic

Curated by ChEMBL


Assay Description
Inhibition of thymidine phosphorylase in T cell lymphomas of Sprague-Dawley rat in presence of 100 uM thymidine and 200 uM phosphate


Bioorg Med Chem Lett 20: 862-5 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.081
BindingDB Entry DOI: 10.7270/Q2930V4K
More data for this
Ligand-Target Pair