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BDBM50322366 1-(4-ethylcyclohexyl)-3-methyl-5-methylene-4,5-dihydro-3H-cyclopenta[a]naphthalene::CHEMBL1171297

SMILES: CCN1CCC(CC1)c1nn(C)c2[nH]c(=O)c3ccccc3c12

InChI Key: InChIKey=BHBMWGCVSKOSHS-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50322366   
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))
BDBM50322366
PNG
(1-(4-ethylcyclohexyl)-3-methyl-5-methylene-4,5-dih...)
Show SMILES CCN1CCC(CC1)c1nn(C)c2[nH]c(=O)c3ccccc3c12
Show InChI InChI=1S/C18H22N4O/c1-3-22-10-8-12(9-11-22)16-15-13-6-4-5-7-14(13)18(23)19-17(15)21(2)20-16/h4-7,12H,3,8-11H2,1-2H3,(H,19,23)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Patents

Article
PubMed
n/an/a 25n/an/an/an/an/an/a



Johns Hopkins University Brain Science Institute

Curated by ChEMBL


Assay Description
Inhibition of PARP1


J Med Chem 53: 4561-84 (2010)


Article DOI: 10.1021/jm100012m
BindingDB Entry DOI: 10.7270/Q2NV9JF0
More data for this
Ligand-Target Pair