Reaction Details  Report a problem with these data
Target
Sigma non-opioid intracellular receptor 1
Ligand
BDBM50608088
Substrate
n/a
Meas. Tech.
ChEMBL_2272500
Ki
2.6±n/a nM
Citation
 Rossino, G; Rui, M; Linciano, P; Rossi, D; Boiocchi, M; Peviani, M; Poggio, E; Curti, D; Schepmann, D; Wünsch, B; González-Avendaño, M; Vergara-Jaque, A; Caballero, J; Collina, S Bitopic Sigma 1 Receptor Modulators to Shed Light on Molecular Mechanisms Underpinning Ligand Binding and Receptor Oligomerization. J Med Chem 64:14997-15016 (2021) [PubMed]
Target
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:
MQWAVGRRWLWVALFLAAVAVLTQIVWLWLGTQNFVFQREEIAQLARQYAGLDHELAFSKLIVELRRLHPVHVLPDEELQWVFVNAGGWMGAMCLLHASLSEYVLLFGTALGSPRHSGRYWAEISDTIISGTFHQWREGTTKSEVFYPGETVVHGPGEATAVEWGPNTWMVEYGRGVIPSTLGFALADTVFSTQDFLTLFYTLRVYARALQLELTTYLFGQDP
  
Inhibitor
Name:
BDBM50608088
Synonyms:
CHEMBL5271242
Type:
Small organic molecule
Emp. Form.:
C48H62N4O4
Mol. Mass.:
759.0303
SMILES:
C[C@H](CCN1CCC(CC1)NC(=O)COCCOCC(=O)NC1CCN(CC[C@@H](C)c2ccc(cc2)-c2ccccc2)CC1)c1ccc(cc1)-c1ccccc1 |r|
Structure:
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