Mechanism Insight of Cell Death Signaling by Thymol Derivatives on Trypanosomatidae Protozoan Parasites

Leishmaniasis and Chagas disease are parasitic diseases considered to be among the most important neglected diseases, with implications for both developed and developing countries. Currently, there are no effective therapeutic treatments for these diseases due to challenges in drug administration, h...

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Main Authors: Amani Omrani, Meriam Ben Youssef, Ines Sifaoui, Eduardo Hernández-Álvarez, Carlos J. Bethencourt-Estrella, Isabel L. Bazzocchi, Hichem Sebai, Jacob Lorenzo-Morales, Ignacio A. Jiménez, José E. Piñero
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Language:English
Published: MDPI AG 2025-04-01
Series:Antibiotics
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Online Access:https://www.mdpi.com/2079-6382/14/4/383
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author Amani Omrani
Meriam Ben Youssef
Ines Sifaoui
Eduardo Hernández-Álvarez
Carlos J. Bethencourt-Estrella
Isabel L. Bazzocchi
Hichem Sebai
Jacob Lorenzo-Morales
Ignacio A. Jiménez
José E. Piñero
author_facet Amani Omrani
Meriam Ben Youssef
Ines Sifaoui
Eduardo Hernández-Álvarez
Carlos J. Bethencourt-Estrella
Isabel L. Bazzocchi
Hichem Sebai
Jacob Lorenzo-Morales
Ignacio A. Jiménez
José E. Piñero
author_sort Amani Omrani
collection DOAJ
description Leishmaniasis and Chagas disease are parasitic diseases considered to be among the most important neglected diseases, with implications for both developed and developing countries. Currently, there are no effective therapeutic treatments for these diseases due to challenges in drug administration, high toxicity, high costs, and drug resistance. In this study, a series of eleven thymol derivatives were designed, synthesized, and evaluated for their in vitro kinetoplastid activity against <i>Leishmania amazonensis</i> and <i>Trypanosoma cruzi</i>, as well as their cytotoxicity against a murine macrophage cell line. The most active compounds, thymol anysoate (<b>9</b>) and thymol picolinate (<b>10</b>), displayed the highest kinetoplastid activity with IC<sub>50</sub> values of 22.87 and 25.16 µM against <i>L. amazonensis</i> and <i>T. cruzi</i>, respectively. Notably, both compounds demonstrated an excellent selectivity index against the mammal cell line. Structure–activity relationship studies revealed that the ester group plays a crucial role in activity. The most promising derivatives, <b>9</b> and <b>10</b>, activate autophagy and apoptosis-like processes in the treated cells. Atomic force microscopy observations showed that derivative <b>9</b> induces the formation of cytoplasmic vacuoles, indicating an autophagic process, and drug-likeness analysis revealed that it meets all the pharmacokinetic criteria. Overall, these results highlight derivative <b>9</b> as a potential lead compound for the development of new drugs for the treatment of Trypanosomatidae infections and warrants further studies to elucidate the cell death cascade involved.
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spelling doaj-art-d6872f447608449b83a4f01abd48d93f2025-08-20T02:17:25ZengMDPI AGAntibiotics2079-63822025-04-0114438310.3390/antibiotics14040383Mechanism Insight of Cell Death Signaling by Thymol Derivatives on Trypanosomatidae Protozoan ParasitesAmani Omrani0Meriam Ben Youssef1Ines Sifaoui2Eduardo Hernández-Álvarez3Carlos J. Bethencourt-Estrella4Isabel L. Bazzocchi5Hichem Sebai6Jacob Lorenzo-Morales7Ignacio A. Jiménez8José E. Piñero9Instituto Universitario de Enfermedades Tropicales y Salud Pública de Canarias, Universidad de La Laguna, 38296 La Laguna, Tenerife, SpainInstituto Universitario de Enfermedades Tropicales y Salud Pública de Canarias, Universidad de La Laguna, 38296 La Laguna, Tenerife, SpainInstituto Universitario de Enfermedades Tropicales y Salud Pública de Canarias, Universidad de La Laguna, 38296 La Laguna, Tenerife, SpainInstituto Universitario de Bio-Orgánica Antonio González, Departamento de Química Orgánica, Universidad de La Laguna, Avenida Astrofísico Francisco Sánchez 2, 38206 La Laguna, Tenerife, SpainInstituto Universitario de Enfermedades Tropicales y Salud Pública de Canarias, Universidad de La Laguna, 38296 La Laguna, Tenerife, SpainInstituto Universitario de Bio-Orgánica Antonio González, Departamento de Química Orgánica, Universidad de La Laguna, Avenida Astrofísico Francisco Sánchez 2, 38206 La Laguna, Tenerife, SpainLaboratory of Functional Physiology and Valorization of Bio-Ressources, Higher Institute of Biotechnology of Beja, University of Jendouba, Beja 382-9000, TunisiaInstituto Universitario de Enfermedades Tropicales y Salud Pública de Canarias, Universidad de La Laguna, 38296 La Laguna, Tenerife, SpainInstituto Universitario de Bio-Orgánica Antonio González, Departamento de Química Orgánica, Universidad de La Laguna, Avenida Astrofísico Francisco Sánchez 2, 38206 La Laguna, Tenerife, SpainInstituto Universitario de Enfermedades Tropicales y Salud Pública de Canarias, Universidad de La Laguna, 38296 La Laguna, Tenerife, SpainLeishmaniasis and Chagas disease are parasitic diseases considered to be among the most important neglected diseases, with implications for both developed and developing countries. Currently, there are no effective therapeutic treatments for these diseases due to challenges in drug administration, high toxicity, high costs, and drug resistance. In this study, a series of eleven thymol derivatives were designed, synthesized, and evaluated for their in vitro kinetoplastid activity against <i>Leishmania amazonensis</i> and <i>Trypanosoma cruzi</i>, as well as their cytotoxicity against a murine macrophage cell line. The most active compounds, thymol anysoate (<b>9</b>) and thymol picolinate (<b>10</b>), displayed the highest kinetoplastid activity with IC<sub>50</sub> values of 22.87 and 25.16 µM against <i>L. amazonensis</i> and <i>T. cruzi</i>, respectively. Notably, both compounds demonstrated an excellent selectivity index against the mammal cell line. Structure–activity relationship studies revealed that the ester group plays a crucial role in activity. The most promising derivatives, <b>9</b> and <b>10</b>, activate autophagy and apoptosis-like processes in the treated cells. Atomic force microscopy observations showed that derivative <b>9</b> induces the formation of cytoplasmic vacuoles, indicating an autophagic process, and drug-likeness analysis revealed that it meets all the pharmacokinetic criteria. Overall, these results highlight derivative <b>9</b> as a potential lead compound for the development of new drugs for the treatment of Trypanosomatidae infections and warrants further studies to elucidate the cell death cascade involved.https://www.mdpi.com/2079-6382/14/4/383thymol derivatives<i>Leishmania amazonensis</i><i>Trypanosoma cruzi</i>structure–activity relationshipmechanism of actiondrug-likeness
spellingShingle Amani Omrani
Meriam Ben Youssef
Ines Sifaoui
Eduardo Hernández-Álvarez
Carlos J. Bethencourt-Estrella
Isabel L. Bazzocchi
Hichem Sebai
Jacob Lorenzo-Morales
Ignacio A. Jiménez
José E. Piñero
Mechanism Insight of Cell Death Signaling by Thymol Derivatives on Trypanosomatidae Protozoan Parasites
Antibiotics
thymol derivatives
<i>Leishmania amazonensis</i>
<i>Trypanosoma cruzi</i>
structure–activity relationship
mechanism of action
drug-likeness
title Mechanism Insight of Cell Death Signaling by Thymol Derivatives on Trypanosomatidae Protozoan Parasites
title_full Mechanism Insight of Cell Death Signaling by Thymol Derivatives on Trypanosomatidae Protozoan Parasites
title_fullStr Mechanism Insight of Cell Death Signaling by Thymol Derivatives on Trypanosomatidae Protozoan Parasites
title_full_unstemmed Mechanism Insight of Cell Death Signaling by Thymol Derivatives on Trypanosomatidae Protozoan Parasites
title_short Mechanism Insight of Cell Death Signaling by Thymol Derivatives on Trypanosomatidae Protozoan Parasites
title_sort mechanism insight of cell death signaling by thymol derivatives on trypanosomatidae protozoan parasites
topic thymol derivatives
<i>Leishmania amazonensis</i>
<i>Trypanosoma cruzi</i>
structure–activity relationship
mechanism of action
drug-likeness
url https://www.mdpi.com/2079-6382/14/4/383
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