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BDBM50341863 5-(4-Nitrobenzamido)isoquinolin-1-one::CHEMBL1767056

SMILES: [O-][N+](=O)c1ccc(cc1)C(=O)Nc1cccc2c1cc[nH]c2=O

InChI Key: InChIKey=FLDGFKKUKRPHAO-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50341863   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
poly-ADP-ribose polymerase 2 (PARP2)


(Mus musculus (Mouse))
BDBM50341863
PNG
(5-(4-Nitrobenzamido)isoquinolin-1-one | CHEMBL1767...)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)Nc1cccc2c1cc[nH]c2=O
Show InChI InChI=1S/C16H11N3O4/c20-15(10-4-6-11(7-5-10)19(22)23)18-14-3-1-2-13-12(14)8-9-17-16(13)21/h1-9H,(H,17,21)(H,18,20)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Inhibition of recombinant full length mouse PARP-2 after 10 mins using [3H]NAD+ by solution-phase assay


J Med Chem 54: 2049-59 (2011)


Article DOI: 10.1021/jm1010918
BindingDB Entry DOI: 10.7270/Q24B31NC
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM50341863
PNG
(5-(4-Nitrobenzamido)isoquinolin-1-one | CHEMBL1767...)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)Nc1cccc2c1cc[nH]c2=O
Show InChI InChI=1S/C16H11N3O4/c20-15(10-4-6-11(7-5-10)19(22)23)18-14-3-1-2-13-12(14)8-9-17-16(13)21/h1-9H,(H,17,21)(H,18,20)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Inhibition of full length human PARP-1 after 10 mins by FlashPlate scintillation proximity assay


J Med Chem 54: 2049-59 (2011)


Article DOI: 10.1021/jm1010918
BindingDB Entry DOI: 10.7270/Q24B31NC
More data for this
Ligand-Target Pair