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Inhibitor Report for: 6o-5-HT3

rat-5-HT3 Ki = 5.6 nM; h-AChE IC50 = 4.1 nM; h-BChE IC50 = 40nM


General
Type Multitarget, 5-HT-receptor-ligand, Derivative of Tacrine, Carboxamide, Alkyl linked bis-ligand
Chemical_Nomenclature 3-methyl-2-(4-methylpiperazin-1-yl)-N-[7-(1,2,3,4-tetrahydroacridin-9-ylamino)heptyl]quinoline-4-carboxamide
Canonical SMILES CC1=C(C2=CC=CC=C2N=C1N3CCN(CC3)C)C(=O)NCCCCCCCNC4=C5CCCCC5=NC6=CC=CC=C64
InChI InChI=1S/C36H46N6O/c1-26-33(27-14-6-9-17-30(27)40-35(26)42-24-22-41(2)23-25-42)36(43)38-21-13-5-3-4-12-20-37-34-28-15-7-10-18-31(28)39-32-19-11-8-16-29(32)34/h6-7,9-10,14-15,17-18H,3-5,8,11-13,16,19-25H2,1-2H3,(H,37,39)(H,38,43)
InChIKey ACKJXXOVSOCBPX-UHFFFAOYSA-N
Other name(s) CHEMBL195241 ; BDBM50166984 ; 3-Methyl-2-(4-methyl-piperazin-1-yl)-quinoline-4-carboxylic acid [7-(1,2,3,4-tetrahydro-acridin-9-ylamino)-heptyl]-amide
________________________________________________________________________________________________
MW|578.8
Formula|C36H46N6O
CAS_number|
PubChem|11376655
UniChem|ACKJXXOVSOCBPX-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | 6o-5-HT3 ligand of proteins in family: BCHE, ACHE
Protein | human-BCHE, human-ACHE

References:
Search PubMed for references concerning: 6o-5-HT3
    Title: Further studies on the interaction of the 5-hydroxytryptamine3 (5-HT3) receptor with arylpiperazine ligands. development of a new 5-HT3 receptor ligand showing potent acetylcholinesterase inhibitory properties
    Cappelli A, Gallelli A, Manini M, Anzini M, Mennuni L, Makovec F, Menziani MC, Alcaro S, Ortuso F, Vomero S
    Ref: Journal of Medicinal Chemistry, 48:3564, 2005 : PubMed