2026-06-27T11:03:47Zhttps://docta.ucm.es/rest/oai/request
oai:docta.ucm.es:20.500.14352/85852024-06-24T15:28:44Zcom_20.500.14352_14col_20.500.14352_15
Docta Complutense author Ramos Alonso, Eva author Lajarín Cuesta, Rocío author Arribas, Raquel L. author García Frutos, Eva M. author González Lafuente, Laura author Egea, Javier author Ríos, Cristóbal de los author Romero Martínez, Manuel Alejandro 2023-06-17T09:18:56Z 2023-06-17T09:18:56Z 2021-02-26 0893-228X 10.1021/acs.chemrestox.0c00519 https://hdl.handle.net/20.500.14352/8585 https://doi.org/10.1021/acs.chemrestox.0c00519 N-Propargylamines are useful synthetic scaffolds for the synthesis of bioactive molecules, and in addition, they possess important pharmacological activities. We obtained several neuroprotective molecules, chiral 1,2-amino alcohols and 1,2-diamines, able to reduce by almost 70% the rotenone and oligomycin A-induced damage in SH-SY5Y cells. Furthermore, some molecules assessed also counteracted the toxicity evoked by the Ser/Thr phosphatase inhibitor okadaic acid. Before extrapolating these data to preclinical studies, we analyze the molecules through an in silico prediction system to detect carcinogenicity risk or other toxic effects. In light of these promising results, these molecules may be considered as a lead family of neuroprotective and relatively safe compounds. eng Atribución 3.0 España In Silico Prediction of the Toxic Potential of Neuroprotective Bifunctional Molecules Based on Chiral N-Propargyl-1,2-amino Alcohol Derivatives journal article URL https://docta.ucm.es/bitstreams/8eec1da6-e59c-4278-8b7e-41261a85cb18/download File MD5 43eb5f00f33a4b088d2d9d4bf3db69fc 1060119 application/pdf acs.chemrestox.0c00519.pdf URL https://docta.ucm.es/bitstreams/74dd9e0b-afb8-4243-8e01-87e434dedc10/download File MD5 1b8b5a3d063ca11779478aedd91b057c 32406 text/plain acs.chemrestox.0c00519.pdf.txt