BDBM80806 3-(1,3-diketobenzo[de]isoquinolin-2-yl)propyl-[6-[3-(1,3-diketobenzo[de]isoquinolin-2-yl)propyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium;bromide::3-(1,3-dioxo-2-benzo[de]isoquinolinyl)propyl-[6-[3-(1,3-dioxo-2-benzo[de]isoquinolinyl)propyl-dimethylammonio]hexyl]-dimethylammonium;bromide::3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl-[6-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium;bromide::3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propyl-[6-[3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propyl-dimethyl-azaniumyl]hexyl]-dimethyl-azanium;bromide::MLS002172486::SMR001254109::WB64::cid_405251

SMILES C[N+](C)(CCCCCC[N+](C)(C)CCCN1C(=O)c2cccc3cccc(C1=O)c23)CCCN1C(=O)c2cccc3cccc(C1=O)c23

InChI Key InChIKey=WNTBFLNHQQTHSU-UHFFFAOYSA-N

Data  3 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 80806   

TargetMuscarinic acetylcholine receptor M2(Pig)
University of W£Rzburg

Curated by ChEMBL
LigandPNGBDBM80806(3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl...)
Affinity DataEC50:  14nMAssay Description:Effective concentration required to inhibit dissociation of [3H]NMS from porcine heart ventricles muscarinic acetylcholine receptor M2.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2020
Entry Details Article
PubMed
TargetHexokinase-1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80806(3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl...)
Affinity DataEC50:  1.79E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/4/2011
Entry Details
PCBioAssay
TargetHexokinase HKDC1 [W721R](Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80806(3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl...)
Affinity DataEC50:  2.04E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay