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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Thymidine phosphorylase' AND taxid = 10090   
Target
(Institution)
LigandTarget
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


(Mus musculus)
BDBM50452155
PNG
(3''-FFdUrd | CHEMBL1098358)
Show SMILES OC[C@H]1O[C@H](C[C@@H]1F)n1cc(F)c(=O)[nH]c1=O
Show InChI InChI=1S/C9H10F2N2O4/c10-4-1-7(17-6(4)3-14)13-2-5(11)8(15)12-9(13)16/h2,4,6-7,14H,1,3H2,(H,12,15,16)/t4-,6+,7+/m0/s1
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PC cid
PC sid
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PubMed
1.70E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated in vitro for non-competitive inhibition of cleavage of Thymidine (dThd) phosphorylase isolated from Lewis lung carcinoma.


J Med Chem 27: 11-4 (1984)

More data for this
Ligand-Target Pair
Thymidine phosphorylase


(Mus musculus)
BDBM50134397
PNG
(5-Methyl-1H-pyrimidine-2,4-dione | CHEMBL993 | THY...)
Show SMILES Cc1c[nH]c(=O)[nH]c1=O
Show InChI InChI=1S/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2H,1H3,(H2,6,7,8,9)
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KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

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PubMed
3.47E+8n/an/an/an/an/an/an/an/a



University of Manchester

Curated by ChEMBL


Assay Description
Inhibitory activity against mouse liver thymidine phosphorylase at 0.15 mM thymidine substrate


Bioorg Med Chem Lett 13: 3705-9 (2003)

More data for this
Ligand-Target Pair