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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Equilibrative nucleoside transporter 1' and Ligand = 'BDBM50413746'   
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
Equilibrative nucleoside transporter 1


(Homo sapiens (Human))
BDBM50413746
PNG
(CHEMBL293957)
Show SMILES COC(=O)c1ccc(CSc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |r|
Show InChI InChI=1S/C19H20N4O6S/c1-28-19(27)11-4-2-10(3-5-11)7-30-17-13-16(20-8-21-17)23(9-22-13)18-15(26)14(25)12(6-24)29-18/h2-5,8-9,12,14-15,18,24-26H,6-7H2,1H3/t12-,14-,15-,18-/m1/s1
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Similars

Article
PubMed
46.8n/an/an/an/an/an/an/an/a



University of Tennessee Health Sciences Center

Curated by ChEMBL


Assay Description
Inhibition of human ENT1


Bioorg Med Chem Lett 19: 314-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.092
BindingDB Entry DOI: 10.7270/Q2H996F3
More data for this
Ligand-Target Pair