Brief Information of the Compound and Protein
Compound Name
5-chloro-4-N-piperidin-4-yl-2-N-(5-thiophen-3-ylpyridin-2-yl)pyrimidine-2,4-diamine
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PubChem ID
CID: 168278253
Canonical SMILES
Clc1cnc(Nc2ccc(cn2)-c2ccsc2)nc1NC1CCNCC1
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Compound Formula C18H19ClN6S
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 = 120.3 nM
   TI
   LI
   LO
   TS
CL000100 U-937 Homo sapiens (Human)  1
1
IC50 = 169.4 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 91.5 nM