Brief Information of the Compound and Protein
Compound Name
5-chloro-2-N-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]-4-N-[3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
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Canonical SMILES
CN1CCN(CC1)c1ccc(Nc2ncc(Cl)c(Nc3cccc(c3)C(F)(F)F)n2)nn1
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Compound Formula C20H20ClF3N8
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 = 120 nM
   TI
   LI
   LO
   TS
CL000100 U-937 Homo sapiens (Human)  1
1
IC50 = 173 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 115 nM