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BDBM50341862 5-(4-Methylbenzamido)isoquinolin-1-one::CHEMBL1767049

SMILES: Cc1ccc(cc1)C(=O)Nc1cccc2c1cc[nH]c2=O

InChI Key: InChIKey=ILBWWQBNKIIFFE-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50341862   
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))
BDBM50341862
PNG
(5-(4-Methylbenzamido)isoquinolin-1-one | CHEMBL176...)
Show SMILES Cc1ccc(cc1)C(=O)Nc1cccc2c1cc[nH]c2=O
Show InChI InChI=1S/C17H14N2O2/c1-11-5-7-12(8-6-11)16(20)19-15-4-2-3-14-13(15)9-10-18-17(14)21/h2-10H,1H3,(H,18,21)(H,19,20)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.50E+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))
BDBM50341862
PNG
(5-(4-Methylbenzamido)isoquinolin-1-one | CHEMBL176...)
Show SMILES Cc1ccc(cc1)C(=O)Nc1cccc2c1cc[nH]c2=O
Show InChI InChI=1S/C17H14N2O2/c1-11-5-7-12(8-6-11)16(20)19-15-4-2-3-14-13(15)9-10-18-17(14)21/h2-10H,1H3,(H,18,21)(H,19,20)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.34E+4n/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