Sigma1R-ACHE-6a
General
Type : Multitarget,5-HT-receptor-ligand,Piperidine,Sigma1R,Indole,Derivative of Donepezil
Chemical_Nomenclature : 1-(7-Chloro-4-methoxy-1H-indol-5-yl)-3-[1-(cyclohexylmethyl)-4-piperidyl]propan-1-one
Canonical SMILES : COC1=C2C=CNC2=C(C=C1C(=O)CCC3CCN(CC3)CC4CCCCC4)Cl
InChI : InChI=1S\/C24H33ClN2O2\/c1-29-24-19-9-12-26-23(19)21(25)15-20(24)22(28)8-7-17-10-13-27(14-11-17)16-18-5-3-2-4-6-18\/h9,12,15,17-18,26H,2-8,10-11,13-14,16H2,1H3
InChIKey : DUUYHLUSDHATNS-UHFFFAOYSA-N
Other name(s) : C6H,MR28926
MW : 416.98
Formula : C24H33ClN2O2
CAS_number :
PubChem : 134828071
UniChem : DUUYHLUSDHATNS-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : Sigma1R-ACHE-6a ligand of proteins in family: ACHE
Stucture : 6EZH Torpedo californica acetylcholinesterase in complex with indolic multi-target directed ligand MR28926
Protein : torca-ACHE
References (1)
| Title : Novel multitarget-directed ligands targeting acetylcholinesterase and sigma1 receptors as lead compounds for treatment of Alzheimer's disease: Synthesis, evaluation, and structural characterization of their complexes with acetylcholinesterase - Lalut_2019_Eur.J.Med.Chem_162_234 |
| Author(s) : Lalut J , Santoni G , Karila D , Lecoutey C , Davis A , Nachon F , Silman I , Sussman JL , Weik M , Maurice T , Dallemagne P , Rochais C |
| Ref : Eur Journal of Medicinal Chemistry , 162 :234 , 2019 |
| Abstract : Lalut_2019_Eur.J.Med.Chem_162_234 |
| ESTHER : Lalut_2019_Eur.J.Med.Chem_162_234 |
| PubMedSearch : Lalut_2019_Eur.J.Med.Chem_162_234 |
| PubMedID: 30447434 |
| Gene_locus related to this paper: torca-ACHE |