Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetSigma non-opioid intracellular receptor 1
LigandBDBM50258047
Substrate/Competitorn/a
Meas. Tech.ChEMBL_566697 (CHEMBL961689)
Ki 1580±n/a nM
Citation Holl, RSchepmann, DFröhlich, RGrünert, RBednarski, PJWünsch, B Dancing of the second aromatic residue around the 6,8-diazabicyclo[3.2.2]nonane framework: influence on sigma receptor affinity and cytotoxicity. J Med Chem52:2126-37 (2009) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Sigma non-opioid intracellular receptor 1
Name:Sigma non-opioid intracellular receptor 1
Synonyms:OPRS1 | SGMR1_CAVPO | SIGMAR1 | Sigma 1-type opioid receptor | Sigma non-opioid intracellular receptor 1 | Sigma-1 receptor | Sigma1-receptor | Sigma1R | Sterol isomerase-like protein
Type:Protein
Mol. Mass.:25307.17
Organism:Cavia porcellus (Guinea pig)
Description:Q60492
Residue:223
Sequence:
MQWAVGRRWLWVALFLAAVAVLTQIVWLWLGTQNFVFQREEIAQLARQYAGLDHELAFSK
LIVELRRLHPVHVLPDEELQWVFVNAGGWMGAMCLLHASLSEYVLLFGTALGSPRHSGRY
WAEISDTIISGTFHQWREGTTKSEVFYPGETVVHGPGEATAVEWGPNTWMVEYGRGVIPS
TLGFALADTVFSTQDFLTLFYTLRVYARALQLELTTYLFGQDP
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50258047
n/a
NameBDBM50258047
Synonyms:(+)-(1R,2S,5S)-6-Allyl-8-(2,4-dimethoxybenzyl)-2-phenoxy-6,8-diazabicyclo[3.2.2]nonane | CHEMBL521812
TypeSmall organic molecule
Emp. Form.C25H32N2O3
Mol. Mass.408.5332
SMILESCOc1ccc(CN2C[C@@H]3CC[C@H](Oc4ccccc4)[C@H]2CN3CC=C)c(OC)c1 |r,TLB:6:7:22.21:10.11.12,13:12:22.21:8.7,THB:23:22:8.7:10.11.12|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: