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BDBM50020628 CHEMBL3290478

SMILES: NC(=O)c1cccc2C(=O)\C(Oc12)=C\c1cc(O)cc(O)c1

InChI Key: InChIKey=ASYLXRWIQKENPT-MLPAPPSSSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50020628   
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))
BDBM50020628
PNG
(CHEMBL3290478)
Show SMILES NC(=O)c1cccc2C(=O)\C(Oc12)=C\c1cc(O)cc(O)c1
Show InChI InChI=1S/C16H11NO5/c17-16(21)12-3-1-2-11-14(20)13(22-15(11)12)6-8-4-9(18)7-10(19)5-8/h1-7,18-19H,(H2,17,21)/b13-6-
PDB
MMDB

UniProtKB/SwissProt

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

Patents

Article
PubMed
n/an/a>1.00E+4n/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