Brief Information of the Compound and Protein
Compound Name
(2S)-1-{2-[(3-hydroxyadamantan-1-yl)amino]acetyl}pyrrolidine-2-carbonitrile
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PubChem ID
CID: 6918537
SID: 14898545
Canonical SMILES
OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1CCC[C@H]1C#N
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Compound Formula C17H25N3O2
Compound Structure
Protein Name
Dipeptidyl peptidase 8
Protein Classification
Enzyme
>
Protease
>
Serine protease
>
Serine protease SC clan
>
Serine protease S9B subfamily
Uniprot ID
Q6V1X1
Gene Name
DPP8
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000023 BTI-Tn-5B1-4 Trichoplusia ni (Cabbage looper)  1
1
IC50 = 14000 nM
   TI
   LI
   LO
   TS
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 2300 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 1.85 nM
2 IC50 = 1100 nM
3 IC50 = 1400 nM
4 IC50 = 1520 nM
5 IC50 = 3820 nM
6 IC50 = 9000 nM
7 IC50 = 14000 nM
8 IC50 = 14200 nM
9 IC50 = 14219 nM
10 Ki = 810 nM
11 Ki = 1342 nM