Brief Information of the Compound and Protein
Compound Name
5-[5-[(1S,5R)-3-(2-methoxyethyl)-3-azabicyclo[3.1.0]hexan-6-yl]-1-propan-2-ylpyrazol-3-yl]-3-(trifluoromethyl)pyridin-2-amine
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Canonical SMILES
COCCN1C[C@H]2[C@@H](C1)[C@@H]2c1cc(nn1C(C)C)-c1cnc(N)c(c1)C(F)(F)F
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Compound Formula C20H26F3N5O
Compound Structure
Protein Name
Mitogen-activated protein kinase kinase kinase 12
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
STE protein kinase group
Uniprot ID
Q12852
Gene Name
MAP3K12
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 265 nM
   TI
   LI
   LO
   TS
CL000012 Sf21 Spodoptera frugiperda (Fall armyworm)  1
1
Ki = 9 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 9.4 nM