Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes

Artículo

Detalles Bibliográficos
Autores: Guzmán Flores, Juan Manuel, Pérez Vázquez, Victoriano, Martínez Esquivias, Fernando, Isiordia Espinoza, Mario Alberto, Viveros Paredes, Juan Manuel
Tipo de recurso: artículo
Estado:Versión publicada
Fecha de publicación:2023
País:México
Institución:Universidad de Guadalajara
Repositorio:Repositorio UDG CUALTOS
OAI Identifier:oai:repositorio.cualtos.udg.mx:123456789/1583
Acceso en línea:https://doi.org/10.3390/ cimb45090457
http://repositorio.cualtos.udg.mx:8080/jspui/handle/123456789/1583
Access Level:acceso abierto
Palabra clave:diabetes
Cannabis sativa
network pharmacology
molecular docking
gene ontology
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spelling Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 DiabetesGuzmán Flores, Juan ManuelPérez Vázquez, VictorianoMartínez Esquivias, FernandoIsiordia Espinoza, Mario AlbertoViveros Paredes, Juan ManueldiabetesCannabis sativanetwork pharmacologymolecular dockinggene ontologyArtículoThe incidence of type 2 diabetes (T2D) is rising, and finding new treatments is important. C. sativa is a plant suggested as a potential treatment for T2D, but how it works needs to be clarified. This study explored the pharmacological mechanism of C. sativa in treating T2D. We identified the active compounds in C. sativa and their targets. From there, we examined the genes associated with T2D and found overlapping genes. We conducted an enrichment analysis and created a protein–protein and target–compound interactions network. We confirmed the binding activities of the hub proteins and compounds with molecular docking. We identified thirteen active compounds from C. sativa, which have 150 therapeutic targets in T2D. The enrichment analysis showed that these proteins are involved in the hormone, lipid, and stress responses. They bind transcription factors and metals and participate in the insulin, PI3K/Akt, HIF-1, and FoxO signaling pathways. We found four hub proteins (EGFR, ESR1, HSP90AA1, and SRC) that bind to the thirteen bioactive compounds. This was verified using molecular docking. Our findings suggest that C. sativa’s antidiabetic action is carried out through the insulin signaling pathway, with the participation of HIF-1 and FoxO.MDPI2024-02-12T19:41:46Z2024-02-12T19:41:46Z2023-09info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articleGuzmán-Flores, J.M.; Pérez-Vázquez, V.; Martínez- Esquivias, F.; Isiordia-Espinoza, M.A.; Viveros-Paredes, J.M. Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes. Curr. Issues Mol. Biol. 2023, 45, 7228–7241. https://doi.org/10.3390/ cimb450904571467-3045https://doi.org/10.3390/ cimb45090457http://repositorio.cualtos.udg.mx:8080/jspui/handle/123456789/1583reponame:Repositorio UDG CUALTOSinstname:Universidad de Guadalajarainstacron:UDGenCurrent Issues in Molecular Biology;2023, 45(9), 7228-7241info:eu-repo/semantics/openAccessoai:repositorio.cualtos.udg.mx:123456789/15832024-10-11T19:20:40Z
dc.title.none.fl_str_mv Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes
title Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes
spellingShingle Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes
Guzmán Flores, Juan Manuel
diabetes
Cannabis sativa
network pharmacology
molecular docking
gene ontology
title_short Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes
title_full Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes
title_fullStr Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes
title_full_unstemmed Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes
title_sort Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes
dc.creator.none.fl_str_mv Guzmán Flores, Juan Manuel
Pérez Vázquez, Victoriano
Martínez Esquivias, Fernando
Isiordia Espinoza, Mario Alberto
Viveros Paredes, Juan Manuel
author Guzmán Flores, Juan Manuel
author_facet Guzmán Flores, Juan Manuel
Pérez Vázquez, Victoriano
Martínez Esquivias, Fernando
Isiordia Espinoza, Mario Alberto
Viveros Paredes, Juan Manuel
author_role author
author2 Pérez Vázquez, Victoriano
Martínez Esquivias, Fernando
Isiordia Espinoza, Mario Alberto
Viveros Paredes, Juan Manuel
author2_role author
author
author
author
dc.subject.none.fl_str_mv diabetes
Cannabis sativa
network pharmacology
molecular docking
gene ontology
topic diabetes
Cannabis sativa
network pharmacology
molecular docking
gene ontology
description Artículo
publishDate 2023
dc.date.none.fl_str_mv 2023-09
2024-02-12T19:41:46Z
2024-02-12T19:41:46Z
dc.type.none.fl_str_mv info:eu-repo/semantics/publishedVersion
info:eu-repo/semantics/article
format article
status_str publishedVersion
dc.identifier.none.fl_str_mv Guzmán-Flores, J.M.; Pérez-Vázquez, V.; Martínez- Esquivias, F.; Isiordia-Espinoza, M.A.; Viveros-Paredes, J.M. Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes. Curr. Issues Mol. Biol. 2023, 45, 7228–7241. https://doi.org/10.3390/ cimb45090457
1467-3045
https://doi.org/10.3390/ cimb45090457
http://repositorio.cualtos.udg.mx:8080/jspui/handle/123456789/1583
identifier_str_mv Guzmán-Flores, J.M.; Pérez-Vázquez, V.; Martínez- Esquivias, F.; Isiordia-Espinoza, M.A.; Viveros-Paredes, J.M. Molecular Docking Integrated with Network Pharmacology Explores the Therapeutic Mechanism of Cannabis sativa against Type 2 Diabetes. Curr. Issues Mol. Biol. 2023, 45, 7228–7241. https://doi.org/10.3390/ cimb45090457
1467-3045
url https://doi.org/10.3390/ cimb45090457
http://repositorio.cualtos.udg.mx:8080/jspui/handle/123456789/1583
dc.language.none.fl_str_mv en
language_invalid_str_mv en
dc.relation.none.fl_str_mv Current Issues in Molecular Biology;2023, 45(9), 7228-7241
dc.rights.none.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.publisher.none.fl_str_mv MDPI
publisher.none.fl_str_mv MDPI
dc.source.none.fl_str_mv reponame:Repositorio UDG CUALTOS
instname:Universidad de Guadalajara
instacron:UDG
instname_str Universidad de Guadalajara
instacron_str UDG
institution UDG
reponame_str Repositorio UDG CUALTOS
collection Repositorio UDG CUALTOS
repository.name.fl_str_mv
repository.mail.fl_str_mv
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