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BDBM50165491 CHEMBL193917::Ethanesulfonic acid [3-(4-oxo-3,4-dihydro-phthalazin-1-ylmethyl)-phenyl]-amide

SMILES: CCS(=O)(=O)Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1

InChI Key: InChIKey=WCPWGYRDASAKSH-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50165491   
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 1


(Homo sapiens (Human))
BDBM50165491
PNG
(CHEMBL193917 | Ethanesulfonic acid [3-(4-oxo-3,4-d...)
Show SMILES CCS(=O)(=O)Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1
Show InChI InChI=1S/C17H17N3O3S/c1-2-24(22,23)20-13-7-5-6-12(10-13)11-16-14-8-3-4-9-15(14)17(21)19-18-16/h3-10,20H,2,11H2,1H3,(H,19,21)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 290n/an/an/an/an/an/a



KuDOS Horsham Ltd

Curated by ChEMBL


Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1)


Bioorg Med Chem Lett 15: 2235-8 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B
More data for this
Ligand-Target Pair