Brief Information of the Compound and Protein
Compound Name
2-N-[5-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)pyridin-2-yl]-5-chloro-4-N-[3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
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Canonical SMILES
FC(F)(F)c1cccc(Nc2nc(Nc3ccc(cn3)N3CCN4CCCCC4C3)ncc2Cl)c1
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Compound Formula C24H25ClF3N7
Compound Structure
Protein Name
Dipeptidyl peptidase 1
Protein Classification
Enzyme
>
Protease
>
Cysteine protease
>
Cysteine protease CA clan
>
Cysteine protease C1A family
Uniprot ID
P53634
Gene Name
CTSC
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000040 THP-1 Homo sapiens (Human)  1
1
IC50 = 247 nM
   TI
   LI
   LO
   TS
CL000100 U-937 Homo sapiens (Human)  1
1
IC50 = 195 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 202 nM