Brief Information of the Compound and Protein
Compound Name
N-ethyl-4-[4-[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperazin-1-yl]benzamide
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PubChem ID
CID: 66716735
Canonical SMILES
CCNC(=O)c1ccc(cc1)N1CCN(Cc2ccc3OC(C)C(=O)Nc3c2)CC1
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Compound Formula C23H28N4O3
Compound Structure
Protein Name
Poly [ADP-ribose] polymerase 1
Protein Classification
Enzyme
>
Transferase
Uniprot ID
P09874
Gene Name
PARP1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000001 Jurkat Homo sapiens (Human)  2
1
EC50 = 15000 nM
   TI
   LI
   LO
   TS
2
EC50 = 42000 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 22 nM