Brief Information of the Compound and Protein
Compound Name
 Compound Info 
2-methyl-N-[2-[3-(prop-2-enoylamino)anilino]pyrimidin-5-yl]-5-[[3-(trifluoromethyl)benzoyl]amino]benzamide
    Show/Hide
 PubChem ID
CID: 71519693
SID: 163511953
Canonical SMILES
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C(=O)Nc1cnc(Nc2cccc(NC(=O)C=C)c2)nc1
    Show/Hide
Compound Formula C29H23F3N6O3
Compound Structure
Protein Name
 Protein Info 
Tyrosine-protein kinase BTK
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
TK protein kinase group
>
Tyrosine protein kinase Tec family
Uniprot ID
Q06187
Gene Name
BTK
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000549 Namalwa
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 18 nM
   TI
   LI
   LO
   TS
CL000003 Ramos
 Cell Line Info 
Homo sapiens (Human)  2
1
EC50 = 18 nM
   TI
   LI
   LO
   TS
2
EC50 = 24 nM
   TI
   LI
   LO
   TS
CL000012 Sf21
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 20.5 nM
   TI
   LI
   LO
   TS
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  2
1
IC50 = 25 nM
   TI
   LI
   LO
   TS
2
Ki = 27.2 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 5 nM