Neocopride
hAChE inhibitor IC50 73 nM (hBuChE inhibition 51% at 105M); agonist of the h5-HT4 receptor Ki of 48 nM
General
Type : Cycloheptyl, Piperidine, Multitarget, 5-HT-receptor-ligand
Chemical_Nomenclature : 1-(4-amino-5-fluoro-2-methoxyphenyl)-3-[1-(cycloheptylmethyl)piperidin-4-yl]propan-1-one
Canonical SMILES : COC1=CC(=C(C=C1C(=O)CCC2CCN(CC2)CC3CCCCCC3)F)N
InChI : InChI=1S\/C23H35FN2O2\/c1-28-23-15-21(25)20(24)14-19(23)22(27)9-8-17-10-12-26(13-11-17)16-18-6-4-2-3-5-7-18\/h14-15,17-18H,2-13,16,25H2,1H3
InChIKey : HKRQNSWIPOUSMA-UHFFFAOYSA-N
Other name(s) : MR36014 || SCHEMBL21866064
MW : 390.5
Formula : C23H35FN2O2
CAS_number :
PubChem : 146493768
UniChem : HKRQNSWIPOUSMA-UHFFFAOYSA-N
Target
Families : Neocopride ligand of proteins in family
ACHE
Protein :
human-ACHE
References (1)
| Title : An efficient step-by-step approach to select pleiotropic drug candidates against Alzheimer's disease: The discovery of neocopride - Rochais_2026_J.Alzheimers.Dis__13872877261424925 |
| Author(s) : Rochais C , Lecoutey C , Culley G , Curel T , Davis A , Duval E , Rouviere L , Henriques A , Legrand R , Claeysen S , Callizot N , Dallemagne P |
| Ref : J Alzheimers Dis , :13872877261424925 , 2026 |
| Abstract : |
| PubMedSearch : Rochais_2026_J.Alzheimers.Dis__13872877261424925 |
| PubMedID: 41823649 |