BDBM91598 alpha7 agonists 2

SMILES Cn1c2ccccc2c(OCc2cn(CC[N+]3(C)CCCCC3)nn2)cc1=O

InChI Key InChIKey=RKSSIFKKHFJSOU-UHFFFAOYSA-N

Data  2 KI  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 91598   

TargetNeuronal acetylcholine receptor subunit alpha-7(Human)
University of California San Diego

LigandPNGBDBM91598(alpha7 agonists 2)
Affinity DataEC50:  1.20E+3nMpH: 7.4 T: 2°CAssay Description:Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 l of 0.2 mg/ml ant...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/26/2012
Entry Details Article
PubMed
TargetNeuronal acetylcholine receptor subunit alpha-4(Human)
University of California San Diego

LigandPNGBDBM91598(alpha7 agonists 2)
Affinity DataKi:  1.20E+4nM ΔG°:  -6.98kcal/molepH: 7.4 T: 2°CAssay Description:Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 l of 0.2 mg/ml ant...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/26/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 3A(Mouse)
University of California San Diego

LigandPNGBDBM91598(alpha7 agonists 2)
Affinity DataKi: >3.00E+4nM ΔG°: >-6.41kcal/molepH: 7.4 T: 2°CAssay Description:Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 l of 0.2 mg/ml ant...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/26/2012
Entry Details Article
PubMed