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BDBM130105 US8815891, 23

SMILES: O=c1[nH]c2ccc(OCCN3CCC(CC3)c3ccccc3)cc2c2NCCCc12

InChI Key: InChIKey=YOXMATWWWZISQA-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 130105   
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))
BDBM130105
PNG
(US8815891, 23)
Show SMILES O=c1[nH]c2ccc(OCCN3CCC(CC3)c3ccccc3)cc2c2NCCCc12
Show InChI InChI=1S/C25H29N3O2/c29-25-21-7-4-12-26-24(21)22-17-20(8-9-23(22)27-25)30-16-15-28-13-10-19(11-14-28)18-5-2-1-3-6-18/h1-3,5-6,8-9,17,19,26H,4,7,10-16H2,(H,27,29)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.43E+3n/an/an/an/a7.425



Jeil Pharmaceutical Co., Ltd

US Patent


Assay Description
The activity of the compounds according to the present invention to inhibit the PARP-1 enzyme was examined using a PARP Assay kit (4671-096-K) purcha...


US Patent US8815891 (2014)


BindingDB Entry DOI: 10.7270/Q2SQ8Z3Z
More data for this
Ligand-Target Pair