4c2-AChE-IN-24
Dimethyl fumarate plus Tranilast modified Dithiocarbate as AChE inhibitor and Nrf2 activator. Dithiocarbamate. Can penetrate the BBB. AChE-IN-24 hAChE IC50 value of 0.053 micro. AChE-IN-24 is a MNrf2 activator and could promote the nuclear translocation of Nrf2 protein
General
Type : Sulfur Compound,Multitarget,Piperidine
Chemical_Nomenclature : methyl (E)-4-[3-[4-(2-methylpiperidine-1-carbothioyl)sulfanylbutoxy]anilino]-4-oxobut-2-enoate
Canonical SMILES : CC1CCCCN1C(=S)SCCCCOC2=CC=CC(=C2)NC(=O)C=CC(=O)OC
InChI : InChI=1S\/C22H30N2O4S2\/c1-17-8-3-4-13-24(17)22(29)30-15-6-5-14-28-19-10-7-9-18(16-19)23-20(25)11-12-21(26)27-2\/h7,9-12,16-17H,3-6,8,13-15H2,1-2H3,(H,23,25)\/b12-11+
InChIKey : NUNYQVNSVRDGSF-VAWYXSNFSA-N
Other name(s) : AChE-IN-24,HY-151152,CS-0572380
MW : 450.6
Formula : C22H30N2O4S2
CAS_number :
PubChem : 165412705
UniChem : NUNYQVNSVRDGSF-VAWYXSNFSA-N
IUPHAR :
Wikipedia :
Target
References (1)
| Title : A multi-target directed ligands strategy for the treatment of Alzheimer's disease: Dimethyl fumarate plus Tranilast modified Dithiocarbate as AChE inhibitor and Nrf2 activator - Guo_2022_Eur.J.Med.Chem_242_114630 |
| Author(s) : Guo J , Cheng M , Liu P , Cao D , Luo J , Wan Y , Fang Y , Jin Y , Xie SS , Liu J |
| Ref : Eur Journal of Medicinal Chemistry , 242 :114630 , 2022 |
| Abstract : Guo_2022_Eur.J.Med.Chem_242_114630 |
| ESTHER : Guo_2022_Eur.J.Med.Chem_242_114630 |
| PubMedSearch : Guo_2022_Eur.J.Med.Chem_242_114630 |
| PubMedID: 35987018 |