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Inhibitor Report for: Cpd17-Tacrine-5-HT6

reversible inhibitor of acetyl- and butyrylcholinesterase (IC50 = 8 nM and IC50 = 24 nM respectively). Inhibit aggregation of amyloid-beta in vitro 75% at 10 microM. 5-HT6R antagonist Ki 13 nM


General
Type Acridine, Derivative of Tacrine, Multitarget, 5-HT-receptor-ligand, Sulfur Compound, Sulfonamide, Indole, Alkyl linked bis-ligand, anti-Abeta-aggregation
Chemical_Nomenclature N1-(2-((1-(phenylsulfonyl)-1H-indol-4-yl)oxy)ethyl)-N2-(1,2,3,4-tetrahydroacridin-9-yl)ethane-1,2-diamine
Canonical SMILES C1(=CC=CC2=C1C=C[N]2[S](=O)(=O)C3=CC=CC=C3)OCCNCCNC4=C6C(=NC5=CC=CC=C45)CCCC6
InChI InChI=1S/C31H32N4O3S/c36-39(37,23-9-2-1-3-10-23)35-21-17-26-29(35)15-8-16-30(26)38-22-20-32-18-19-33-31-24-11-4-6-13-27(24)34-28-14-7-5-12-25(28)31/h1-4,6,8-11,13,15-17,21,32H,5,7,12,14,18-20,22H2,(H,33,34)
InChIKey ZJGZDAGZMPYZKM-UHFFFAOYSA-N
Other name(s)
________________________________________________________________________________________________
MW|540.67
Formula|C31H32N4O3S
CAS_number|
PubChem|
UniChem|ZJGZDAGZMPYZKM-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | Cpd17-Tacrine-5-HT6 ligand of proteins in family: ACHE, BCHE

References:
Search PubMed for references concerning: Cpd17-Tacrine-5-HT6
    Title: Discovery of 1-(phenylsulfonyl)-1H-indole-based multifunctional ligands targeting cholinesterases and 5-HT(6) receptor with anti-aggregation properties against amyloid-beta and tau
    Wichur T, Pasieka A, Godyn J, Panek D, Goral I, Latacz G, Honkisz-Orzechowska E, Bucki A, Siwek A and Wieckowska A <7 more author(s)>
    Ref: Eur Journal of Medicinal Chemistry, 225:113783, 2021 : PubMed