Brief Information of the Compound and Protein
Compound Name
 Compound Info 
4-Dimethylamino-but-2-enoic acid {4-[3-chloro-4-(pyridin-2-ylmethoxy)-phenylamino]-3-cyano-7-ethoxy-quinolin-6-yl}-amide
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 PubChem ID
CID: 9915743
SID: 14886227
Canonical SMILES
CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
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Compound Formula C30H29ClN6O3
Compound Structure
Protein Name
 Protein Info 
Receptor tyrosine-protein kinase erbB-2
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
TK protein kinase group
>
Tyrosine protein kinase EGFR family
Uniprot ID
P04626
Gene Name
ERBB2
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  2
1
IC50 = 5.57 nM
   TI
   LI
   LO
   TS
2
IC50 = 9.7 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 1 nM
2 IC50 = 1.76 nM
3 IC50 = 4.4 nM
4 IC50 = 4.57 nM
5 IC50 = 6.09 nM
6 IC50 = 29.33 nM
7 IC50 = 59 nM
8 IC50 = 60 nM
9 Kd = 6 nM