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Target
Sigma intracellular receptor 2
Ligand
BDBM50521525
Substrate
n/a
Meas. Tech.
ChEMBL_1884527 (CHEMBL4386109)
Ki
30±n/a nM
Citation
 Kronenberg, E; Weber, F; Brune, S; Schepmann, D; Almansa, C; Friedland, K; Laurini, E; Pricl, S; Wünsch, B Synthesis and Structure-Affinity Relationships of Spirocyclic Benzopyrans with Exocyclic Amino Moiety. J Med Chem 62:4204-4217 (2019) [PubMed]  Article 
Target
Name:
Sigma intracellular receptor 2
Synonyms:
S2r | SGMR2_RAT | Sigma intracellular receptor 2 | Sigma-2 receptor | Sigma2 receptor | Tmem97 | Transmembrane protein 97
Type:
Protein
Mol. Mass.:
20953.88
Organism:
Rattus norvegicus (Rat)
Description:
Q5U3Y7
Residue:
176
Sequence:
MGAVTARRCVEWLLGLYFVSHIPITMFIDLQALLPPELYPQEFSNLLRWYSKEFKDPLMQEPPVWFKSFLFCELVFQLPFFPIAAYAFFKGSCRWIRIPAIIYAVHTITTLIPILYTILFEDFSKAIAFKGQRPENFRERLTLVGVYAPYLIIPLILLLFMLRNPYYKFEEKRKKK
  
Inhibitor
Name:
BDBM50521525
Synonyms:
CHEMBL4562709
Type:
Small organic molecule
Emp. Form.:
C22H33NO
Mol. Mass.:
327.5035
SMILES:
CN(CC1CCCCC1)[C@H]1CC[C@]2(CC1)OCCc1ccccc21 |r,wU:12.16,9.9,(52.67,-10.46,;54.01,-9.7,;55.34,-10.48,;56.68,-9.72,;58,-10.51,;59.33,-9.75,;59.35,-8.21,;58.02,-7.43,;56.68,-8.19,;54.02,-8.16,;52.69,-7.38,;52.7,-5.85,;54.04,-5.09,;55.37,-5.86,;55.36,-7.4,;55.4,-4.32,;55.4,-2.77,;54.05,-1.98,;52.71,-2.76,;51.38,-2,;50.05,-2.77,;50.05,-4.31,;51.38,-5.08,;52.71,-4.32,)|
Structure:
Search PDB for entries with ligand similarity: