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BDBM27116 2-(1-methylpiperidin-3-yl)-1H-1,3-benzodiazole-4-carboxamide::cyclic amine-containing benzimidazole carboxamide, 9a

SMILES: CN1CCCC(C1)c1nc2cccc(C(N)=O)c2[nH]1

InChI Key: InChIKey=MPKSUIKAIGEMEY-UHFFFAOYSA-N

Data: 1 KI

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 27116   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27116
PNG
(2-(1-methylpiperidin-3-yl)-1H-1,3-benzodiazole-4-c...)
Show SMILES CN1CCCC(C1)c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C14H18N4O/c1-18-7-3-4-9(8-18)14-16-11-6-2-5-10(13(15)19)12(11)17-14/h2,5-6,9H,3-4,7-8H2,1H3,(H2,15,19)(H,16,17)
PDB
MMDB

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Similars

Article
PubMed
30 -10.2n/an/an/an/an/a8.022



Abbott Laboratories



Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


Bioorg Med Chem 16: 6965-75 (2008)


Article DOI: 10.1016/j.bmc.2008.05.044
BindingDB Entry DOI: 10.7270/Q2JD4V3X
More data for this
Ligand-Target Pair