Brief Information of the Compound and Protein
Compound Name
(R)-1-(3-(4-Amino-3-(3-chloro-4-(pyridin-2-ylmethoxy)phenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)prop-2-en-1-one
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PubChem ID
CID: 127264586
Canonical SMILES
C=CC(=O)N1CCC[C@@H](n2nc(-c3ccc(OCc4ccccn4)c(Cl)c3)c3c(N)ncnc32)C1
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Compound Formula C25H24ClN7O2
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
CL000068 A-549 Homo sapiens (Human)  1
1
GI50 > 10000 nM
   TI
   LI
   LO
   TS
CL000077 Ba/F3 Mus musculus (Mouse)  7
1
EC50 = 7 nM
   TI
   LI
   LO
   TS
2
EC50 = 70 nM
   TI
   LI
   LO
   TS
3
GI50 = 4 nM
   TI
   LI
   LO
   TS
4
GI50 = 2000 nM
   TI
   LI
   LO
   TS
5
GI50 = 2300 nM
   TI
   LI
   LO
   TS
6
GI50 = 4600 nM
   TI
   LI
   LO
   TS
7
GI50 = 7900 nM
   TI
   LI
   LO
   TS
CL000380 HCC827 Homo sapiens (Human)  2
1
EC50 < 10 nM
   TI
   LI
   LO
   TS
2
GI50 = 15 nM
   TI
   LI
   LO
   TS
CL000957 NCI-H1355 Homo sapiens (Human)  1
1
GI50 > 10000 nM
   TI
   LI
   LO
   TS
CL000960 NCI-H1703 Homo sapiens (Human)  1
1
GI50 = 8300 nM
   TI
   LI
   LO
   TS
CL000157 NCI-H1975 Homo sapiens (Human)  2
1
EC50 < 10 nM
   TI
   LI
   LO
   TS
2
GI50 = 5 nM
   TI
   LI
   LO
   TS
CL000401 NCI-H2122 Homo sapiens (Human)  1
1
GI50 > 10000 nM
   TI
   LI
   LO
   TS
CL000324 NCI-H3255 Homo sapiens (Human)  2
1
EC50 < 10 nM
   TI
   LI
   LO
   TS
2
GI50 = 75 nM
   TI
   LI
   LO
   TS
CL000379 PC-9 Homo sapiens (Human)  2
1
EC50 < 10 nM
   TI
   LI
   LO
   TS
2
GI50 = 4 nM
   TI
   LI
   LO
   TS