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BDBM50020622 CHEMBL3290472

SMILES: COc1ccc(\C=C2/Oc3c(cccc3C(N)=O)C2=O)cc1

InChI Key: InChIKey=OWNILGXARMELDO-ZROIWOOFSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50020622   
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))
BDBM50020622
PNG
(CHEMBL3290472)
Show SMILES COc1ccc(\C=C2/Oc3c(cccc3C(N)=O)C2=O)cc1
Show InChI InChI=1S/C17H13NO4/c1-21-11-7-5-10(6-8-11)9-14-15(19)12-3-2-4-13(17(18)20)16(12)22-14/h2-9H,1H3,(H2,18,20)/b14-9-
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.30E+3n/an/an/an/an/an/a



St. John's University

Curated by ChEMBL


Assay Description
Inhibition of PARP-1 (unknown origin) using biotinylated NAD+ as substrate after 60 mins by spectrophotometry


J Med Chem 57: 5579-601 (2014)


Article DOI: 10.1021/jm5002502
BindingDB Entry DOI: 10.7270/Q28C9XSS
More data for this
Ligand-Target Pair