CHEMBL3407591-Cpd2
acetylcholinesterase inhibitory activity IC50=0.52 microM Monoamine-oxidase A MAO-A IC50 0.0077 microM
General
Type : Quinoline, Carbamate, Monoamine-oxidase-inhibitor, Multitarget, Alkyne, Propargyl
Chemical_Nomenclature : [5-[[methyl(prop-2-ynyl)amino]methyl]quinolin-8-yl] N,N-dimethylcarbamate
Canonical SMILES : CN(C)C(=O)OC1=C2C(=C(C=C1)CN(C)CC#C)C=CC=N2
InChI : InChI=1S\/C17H19N3O2\/c1-5-11-20(4)12-13-8-9-15(22-17(21)19(2)3)16-14(13)7-6-10-18-16\/h1,6-10H,11-12H2,2-4H3
InChIKey : JWUFDSSCTMPGLI-UHFFFAOYSA-N
Other name(s) : Compound 2 || Prochelators, 2 || SCHEMBL608520 || CHEMBL3407591 || BDBM36552 || 5-(N-methyl-N-propargylaminomethyl) quinolin-8-yl dimethyl carbamate
MW : 297.35
Formula : C17H19N3O2
CAS_number :
PubChem : 46863225
UniChem : JWUFDSSCTMPGLI-UHFFFAOYSA-N
Target
Families : CHEMBL3407591-Cpd2 ligand of proteins in family
ACHE
Protein :
human-ACHE
References (3)
| Title : Design, synthesis and biological evaluation of tacrine-1,2,3-triazole derivatives as potent cholinesterase inhibitors - Wu_2018_Medchemcomm_9_149 |
| Author(s) : Wu G , Gao Y , Kang D , Huang B , Huo Z , Liu H , Poongavanam V , Zhan P , Liu X |
| Ref : Medchemcomm , 9 :149 , 2018 |
| Abstract : |
| PubMedSearch : Wu_2018_Medchemcomm_9_149 |
| PubMedID: 30108908 |
| Title : New acetylcholinesterase inhibitors for Alzheimer's disease - Mehta_2012_Int.J.Alzheimers.Dis_2012_728983 |
| Author(s) : Mehta M , Adem A , Sabbagh M |
| Ref : Int J Alzheimers Dis , 2012 :728983 , 2012 |
| Abstract : |
| PubMedSearch : Mehta_2012_Int.J.Alzheimers.Dis_2012_728983 |
| PubMedID: 22216416 |
| Title : Site-activated chelators targeting acetylcholinesterase and monoamine oxidase for Alzheimer's therapy - Zheng_2010_ACS.Chem.Biol_5_603 |
| Author(s) : Zheng H , Youdim MB , Fridkin M |
| Ref : ACS Chemical Biology , 5 :603 , 2010 |
| Abstract : |
| PubMedSearch : Zheng_2010_ACS.Chem.Biol_5_603 |
| PubMedID: 20455574 |