Brief Information of the Compound and Protein
Compound Name
 Compound Info 
[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S)-1-(2-fluorophenyl)ethyl]amino]pyrazolo[3,4-b]pyridin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid
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 PubChem ID
CID: 130205852
Canonical SMILES
C[C@H](Nc1cc(Cl)nc2n(ncc12)[C@@H]1O[C@H](COP(O)(=O)CP(O)(O)=O)[C@@H](O)[C@H]1O)c1ccccc1F
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Compound Formula C20H24ClFN4O9P2
Compound Structure
Protein Name
 Protein Info 
5'-nucleotidase
Protein Classification
Enzyme
>
Phosphatase
Uniprot ID
P21589
Gene Name
NT5E
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  2
1
IC50 = 0.041 nM
   TI
   LI
   LO
   TS
2
IC50 = 0.86 nM
   TI
   LI
   LO
   TS
CL000563 NCI-H1568
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 3.3 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 0.043 nM