Brief Information of the Compound and Protein
Compound Name
 Compound Info 
US10112907, Example 00033
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 PubChem ID
CID: 49831257
SID: 103906062
Canonical SMILES
O=C(Nc1nc2cccc(-c3ccc(CN4CCS(=O)(=O)CC4)cc3)n2n1)C1CC1
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Compound Formula C21H23N5O3S
Compound Structure
Protein Name
 Protein Info 
Tyrosine-protein kinase JAK1
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
TK protein kinase group
>
Tyrosine protein kinase JakB family
Uniprot ID
P23458
Gene Name
JAK1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000077 Ba/F3
 Cell Line Info 
Mus musculus (Mouse)  1
1
GI50 = 798 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 10 nM
2 IC50 = 26.2 nM
3 IC50 = 33 nM
4 IC50 = 115 nM
5 IC50 = 363 nM
6 IC50 = 629 nM
7 IC50 = 636 nM
8 Kd = 11 nM