Brief Information of the Compound and Protein
Compound Name
 Compound Info 
N-(2-aminophenyl)-4-[[(4-pyridin-3-ylpyrimidin-2-yl)amino]methyl]benzamide
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 PubChem ID
CID: 9865515
SID: 14830272
Canonical SMILES
Nc1ccccc1NC(=O)c1ccc(CNc2nccc(n2)-c2cccnc2)cc1
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Compound Formula C23H20N6O
Compound Structure
Protein Name
 Protein Info 
Histone deacetylase 1
Protein Classification
Epigenetic regulator
>
Eraser
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Histone deacetylase
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HDAC class I
Uniprot ID
Q13547
Gene Name
HDAC1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000023 BTI-Tn-5B1-4
 Cell Line Info 
Trichoplusia ni (Cabbage looper)  2
1
IC50 = 390 nM
   TI
   LI
   LO
   TS
2
IC50 = 950 nM
   TI
   LI
   LO
   TS
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 130 nM
   TI
   LI
   LO
   TS
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 102 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 68.2 nM
2 IC50 = 86.3 nM
3 IC50 = 98 nM
4 IC50 = 150 nM
5 IC50 = 152 nM
6 IC50 = 171 nM
7 IC50 = 184 nM
8 IC50 = 820 nM
9 Ki = 9 nM