Brief Information of the Compound and Protein
Compound Name
4-[5-(2-Carbamoyl-2-cyano-vinyl)-2-hydroxy-3-methoxy-benzylsulfanyl]-butyric acid
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PubChem ID
CID: 44345334
Canonical SMILES
COc1cc(\C=C(/C#N)C(N)=O)cc(CSCCCC(O)=O)c1O
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Compound Formula C16H18N2O5S
Compound Structure
Protein Name
Epidermal growth factor receptor
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
TK protein kinase group
>
Tyrosine protein kinase EGFR family
Uniprot ID
P00533
Gene Name
EGFR
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000035 NIH 3T3 Mus musculus (Mouse)  1
1
IC50 = 6500 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 48000 nM
2 IC50 = 60000 nM