Brief Information of the Compound and Protein
Compound Name
3-oxo-2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]-1H-isoindole-4-carboxamide
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PubChem ID
CID: 73776942
Canonical SMILES
NC(=O)c1cccc2CN(C3CCN(Cc4ccsc4)CC3)C(=O)c12
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Compound Formula C19H21N3O2S
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
CL000017 HeLa Homo sapiens (Human)  1
1
IC50 = 1000 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Kd < 30 nM