BDBM393454 2-(azepan-1- yl)-1-(8- methyl-3,4- dihydro- pyrazino[1,2- a]indol- 2(1H)-yl)propan-1-one::US9963453, 13

SMILES CC(N1CCCCCC1)C(=O)N1CCn2c(C1)cc1cc(C)ccc21

InChI Key InChIKey=SOIMPFVFGVAZQW-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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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 = 393454   

TargetSigma non-opioid intracellular receptor 1(Human)
Laboratorios Del Dr. Esteve

US Patent
LigandPNGBDBM393454(US9963453, 13 | 2-(azepan-1- yl)-1-(8- methyl-3,4-...)
Affinity DataKi:  69.7nMAssay Description:To investigate binding properties of sigma 1 receptor ligands to human sigma 1 receptor, transfected HEK-293 membranes and [3H](+)-pentazocine (Perki...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/30/2020
Entry Details
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