Frontiers in Chemistry | Medicinal and Pharmaceutical Chemistry

Original Research

Published on 28 Mar 2025

Exploring the therapeutic mechanism of curcumin in spinal cord injury treatment based on network pharmacology, molecular dynamics simulation, and experimental validation

in Medicinal and Pharmaceutical Chemistry

Yongzhi He
Jiachun Lu
Yushan Luo
Rizhao Pang
Xiaoming Hu
Lijuan Ding
Hua Xiao
Yunyun Wang
Wenchun Wang

Frontiers in Chemistry

doi 10.3389/fchem.2025.1568551

Original Research

Published on 28 Mar 2025

Synthesis, bioactivity, and molecular docking studies: novel arylpiperazine derivatives as potential new-resistant AR antagonists

in Medicinal and Pharmaceutical Chemistry

Hua Jiang
Haowei Chen
Ya Wang
Huaxin Xu
Hong Chen

Frontiers in Chemistry

doi 10.3389/fchem.2025.1557275

100 views

Mini Review

Accepted on 27 Mar 2025

The quinoline framework and related scaffolds in natural products with anti-Leishmania properties

in Medicinal and Pharmaceutical Chemistry

Gloria Yaluff
Leidi Maira Herrera
Miriam Rolon
Celeste Vega
Hugo Cerecetto

Frontiers in Chemistry

doi 10.3389/fchem.2025.1571067

Original Research

Published on 26 Mar 2025

Structure-based identification of bioactive phytochemicals targeting kallikrein-related peptidase 2 for prostate cancer therapy

in Medicinal and Pharmaceutical Chemistry

Deeba Shamim Jairajpuri
Afzal Hussain
Mohamed F. Alajmi
Taj Mohammad
Anas Shamsi
Md. Imtaiyaz Hassan

Frontiers in Chemistry

doi 10.3389/fchem.2025.1553987

218 views

Original Research

Accepted on 25 Mar 2025

Toxicity Mechanism Analysis of cGAS-STING-TBK1 Signaling Pathway Small Molecule Modulator Based on Network Toxicology and Molecular Docking Strategy: Quinacrine Acetate as an example

in Medicinal and Pharmaceutical Chemistry

Jinchao Zhu
Qingyuan Lin
Honglin Zhu
Shengdong Nie

Frontiers in Chemistry

doi 10.3389/fchem.2025.1584588

Original Research

Published on 24 Mar 2025

Chemoinformatics analysis of Mangifera indica leaves extracted phytochemicals as potential EGFR kinase modulators

in Medicinal and Pharmaceutical Chemistry

Md. Abdullah Al Mashud
Ajoy Kumer
Ismat Jahan
Md. Mehedi Hasan Somrat
Md. Enamul Kabir Talukder
Md. Mashiar Rahman
A. F. M. Shahab Uddin
Md. Harun-Or-Rashid
Md. Mizanur Rahman
Mohammad Harun-Ur-Rashid

Frontiers in Chemistry

doi 10.3389/fchem.2025.1524384

590 views

Original Research

Published on 21 Mar 2025

Exploring the antimicrobial potential of lactobacilli against early-stage and mature biofilms of Staphylococcus aureus and Pseudomonas aeruginosa

in Medicinal and Pharmaceutical Chemistry

Niharika Singh
Rohini Devidas Gulhane
Anamika Singh
Maitri Goel
Pudke Payal Udelal
Vikas Sangwan
Manvesh Kumar Sihag
Gunjan Goel
Harsh Panwar
Anil Kumar Puniya

Frontiers in Chemistry

doi 10.3389/fchem.2025.1425666

410 views

Original Research

Accepted on 20 Mar 2025

Chemical profile of Rhododendron luteum Sweet leaf supercritical CO2 extracts and their anti-inflammatory and antidiabetic potential

in Medicinal and Pharmaceutical Chemistry

Lena Łyko
Renata Nowak
Marta Olech
Urszula Gawlik
Agnieszka Krajewska
Danuta Kalemba
Andriy Prokopiv

Frontiers in Chemistry

doi 10.3389/fchem.2025.1576852

Original Research

Accepted on 18 Mar 2025

Computational Identification of Potential Natural Terpenoid Inhibitors of MDM2 for Breast Cancer Therapy: Molecular Docking, Dynamics, and ADMET Analysis

in Medicinal and Pharmaceutical Chemistry

Eva Azme
Md. Mahmudul Hasan
Md. Liakot Ali
Rashedul Alam
Neamul Hoque
Fabiha Noushin
Mohammad Fazlul Kabir
Ashraful Islam
Tanzina Sharmin Nipun
S. M. Moazzem Hossen

Frontiers in Chemistry

doi 10.3389/fchem.2025.1527008

Original Research

Published on 17 Mar 2025

Composite nanoparticle-based vesicles achieve enhanced delivery effects of the natural plant extract of the root, stem, and fruit

in Medicinal and Pharmaceutical Chemistry

Xiaodong Zhuang
Ting Ma
Risheng Liu
Xingyue Fang
Liangjiu Huang

Frontiers in Chemistry

doi 10.3389/fchem.2025.1552298

284 views

Original Research

Published on 12 Mar 2025

Exploring shared therapeutic targets for Alzheimer’s disease and glioblastoma using network pharmacology and protein-protein interaction approach

in Medicinal and Pharmaceutical Chemistry

Sushma Pradeep
M. R. Sai Chakith
S. R. Sindhushree
Pruthvish Reddy
Esther Sushmitha
Madhusudan N. Purohit
Divya Suresh
Nanjunda Swamy Shivananju
Ekaterina Silina
Natalia Manturova

Frontiers in Chemistry

doi 10.3389/fchem.2025.1549186

455 views

Original Research

Accepted on 11 Mar 2025

Discovery of a novel 4-Pyridyl SLC-0111 Analog Targeting Tumor-Associated Carbonic Anhydrase Isoform IX Through Tail-Based Design Approach with Potent Anticancer Activity

in Medicinal and Pharmaceutical Chemistry

Hamada Hashem
Shadwa Abdelfattah
Hesham Hassan
Ahmed Al-Emam
Mohammed Alqarni
Ghallab Alotaibi
Ibrahim Taha Radwan
Kirandeep Kaur
Devendra Pratap Rao
Stefan Bräse

Frontiers in Chemistry

doi 10.3389/fchem.2025.1571646

176 views

Original Research

Published on 10 Mar 2025

The traditional Chinese medicine formula Zhihan Anshen Tang (ZHAST) against obstructive sleep apnea hypopnea syndrome: network pharmacology and molecular docking approach

in Medicinal and Pharmaceutical Chemistry

Cai-Li Li
Yu-Xiang Zhang
Xing-Jie Zheng
Shuo Li
Jing Feng

Frontiers in Chemistry

doi 10.3389/fchem.2025.1524087

528 views

Original Research

Published on 07 Mar 2025

Elicitor-driven enhancement of phenolic compounds in geranium callus cultures: phytochemical profiling via LC-MS/MS and biological activities

in Medicinal and Pharmaceutical Chemistry

Amine Elbouzidi
Mohamed Taibi
Abdellah Baraich
Mounir Haddou
Ramzi A. Mothana
Sami A. Alsufyani
Hany W. Darwish
Roland Molinié
Jean-Xavier Fontaine
Ophélie Fliniaux

Frontiers in Chemistry

doi 10.3389/fchem.2025.1537877

519 views

Original Research

Accepted on 06 Mar 2025

Healing and Leishmanicidal Activity of Zanthoxylum rhoifolium Lam

in Medicinal and Pharmaceutical Chemistry

Juliana Correa-Barbosa
Heliton Patrick Cordovil Brígido
Bibiana Franzen Matte
Paloma Santos De Campos
MARCELO LAMERS
Daniele Ferreira-Sodré
PEDRO HENRIQUE COSTA NASCIMENTO
Gleison Gonçalves Ferreira
Valdicley Vieira Vale
Andrey Moacir R Marinho

Frontiers in Chemistry

doi 10.3389/fchem.2025.1504998

Mini Review

Accepted on 05 Mar 2025

4-Aminoquinoline: A Comprehensive Review about Synthetic Strategies

in Medicinal and Pharmaceutical Chemistry

Angel Romero
Francisco Delgado
Andrés Benítez
Lourdes Gotopo

Frontiers in Chemistry

doi 10.3389/fchem.2025.1553975

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Articles

Exploring the therapeutic mechanism of curcumin in spinal cord injury treatment based on network pharmacology, molecular dynamics simulation, and experimental validation

Synthesis, bioactivity, and molecular docking studies: novel arylpiperazine derivatives as potential new-resistant AR antagonists

The quinoline framework and related scaffolds in natural products with anti-Leishmania properties

Structure-based identification of bioactive phytochemicals targeting kallikrein-related peptidase 2 for prostate cancer therapy

Toxicity Mechanism Analysis of cGAS-STING-TBK1 Signaling Pathway Small Molecule Modulator Based on Network Toxicology and Molecular Docking Strategy: Quinacrine Acetate as an example

Chemoinformatics analysis of Mangifera indica leaves extracted phytochemicals as potential EGFR kinase modulators

Exploring the antimicrobial potential of lactobacilli against early-stage and mature biofilms of Staphylococcus aureus and Pseudomonas aeruginosa

Chemical profile of Rhododendron luteum Sweet leaf supercritical CO2 extracts and their anti-inflammatory and antidiabetic potential

Computational Identification of Potential Natural Terpenoid Inhibitors of MDM2 for Breast Cancer Therapy: Molecular Docking, Dynamics, and ADMET Analysis

Composite nanoparticle-based vesicles achieve enhanced delivery effects of the natural plant extract of the root, stem, and fruit

Exploring shared therapeutic targets for Alzheimer’s disease and glioblastoma using network pharmacology and protein-protein interaction approach

Discovery of a novel 4-Pyridyl SLC-0111 Analog Targeting Tumor-Associated Carbonic Anhydrase Isoform IX Through Tail-Based Design Approach with Potent Anticancer Activity

The traditional Chinese medicine formula Zhihan Anshen Tang (ZHAST) against obstructive sleep apnea hypopnea syndrome: network pharmacology and molecular docking approach

Elicitor-driven enhancement of phenolic compounds in geranium callus cultures: phytochemical profiling via LC-MS/MS and biological activities

Healing and Leishmanicidal Activity of Zanthoxylum rhoifolium Lam

4-Aminoquinoline: A Comprehensive Review about Synthetic Strategies