Frontiers in Chemistry | Medicinal and Pharmaceutical Chemistry

Original Research

Published on 13 Feb 2025

Anti-proliferative effects of a polyherbal formulation on HL-60, HCT-116, and HeLa cell lines: a docking simulation and response surface design-aided study

in Medicinal and Pharmaceutical Chemistry

Chukwuebuka Egbuna
Kingsley C. Patrick-Iwuanyanwu
Eugene N. Onyeike
Johra Khan
Sahar AlDosari
Sadaf Jahan
Kamoru A. Adedokun
Sikiru O. Imodoye
Ibrahim O. Bello
Chukwuemelie Z. Uche

Frontiers in Chemistry

doi 10.3389/fchem.2025.1487887

731 views

Original Research

Accepted on 12 Feb 2025

Antioxidant Activity and Selective Cytotoxicity in HCT-116 and WI-38 cell Lines of LC-MS/MS profiled extract from Capparis spinosa L

in Medicinal and Pharmaceutical Chemistry

Amjad Ibrahim Oraibia
Ashour H. Dawoodd
Ghada Trabelsi
Ousman B.Mahamat
Leila chekir -Ghedira
Soumaya Kilani

Frontiers in Chemistry

doi 10.3389/fchem.2025.1540174

104 views

Original Research

Published on 12 Feb 2025

Design, synthesis, and in vitro, in vivo, and in silico evaluation of novel substituted 1,3,4-thiadiazole derivatives as anticonvulsant agents

in Medicinal and Pharmaceutical Chemistry

Tulika Anthwal
Swati Pant
Preeti Rana
Sumitra Nain

Frontiers in Chemistry

doi 10.3389/fchem.2024.1515866

634 views

Original Research

Accepted on 10 Feb 2025

Composite Nanoparticles-based Vesicles Achieve Enhanced Delivery Effect of the Natural Plant Extract of 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

Original Research

Accepted on 07 Feb 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. Mizanur Rahman
Mohammad Harun-Ur-Rashid
Gamal A. Shazly

Frontiers in Chemistry

doi 10.3389/fchem.2025.1524384

219 views

Original Research

Published on 04 Feb 2025

Molecular characterization, chemical profile and biological properties of essential oils from Chamaemelum nobile (L.) flowers of Morocco: in vitro and in silico studies

in Medicinal and Pharmaceutical Chemistry

El-Mehdi El-Assri
Youssef El-Assri
Rajae El Brahimi
Mohamed El fadili
Asmae Baghouz
Hatem A. Abuelizz
Sara Er-Rahmani
Amal Lahkimi
Abdelhak Bouia

Frontiers in Chemistry

doi 10.3389/fchem.2025.1539872

623 views

Editorial

Published on 03 Feb 2025

Editorial: Exploring novel approaches to small molecule kinase inhibitors in cancer treatment

in Medicinal and Pharmaceutical Chemistry

Anna Carbone
Rafael M. Couñago
Cristian O. Salas
Alessandra Moltalbano

Frontiers in Chemistry

doi 10.3389/fchem.2025.1559849

501 views

Original Research

Accepted on 31 Jan 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
Maitri Goel
Pudke Payal Udelal
Anamika Singh
Vikas Sangwan
Manvesh Kumar Sihag
Gunjan Goel
Harsh Panwar
Anil Kumar Puniya

Frontiers in Chemistry

doi 10.3389/fchem.2025.1425666

163 views

Review

Published on 29 Jan 2025

4-Aminoquinoline as a privileged scaffold for the design of leishmanicidal agents: structure–property relationships and key biological targets

in Medicinal and Pharmaceutical Chemistry

Angel H. Romero
Francisco Delgado

Frontiers in Chemistry

doi 10.3389/fchem.2024.1527946

664 views

Original Research

Published on 29 Jan 2025

Bis(7)-harmine derivatives as potential multi-target anti-Alzheimer agents

in Medicinal and Pharmaceutical Chemistry

Hongtao Du
Fang Ma
Yuanyuan Cao
Miaoyan Bai
Xinyi Gao
Ziyi Yang
Yang Xu
Yan Yan

Frontiers in Chemistry

doi 10.3389/fchem.2025.1545908

555 views

Original Research

Published on 24 Jan 2025

Anti-cancer activity of synthetic gefitinib-1,2,3-triazole derivatives against Hela cells via induction of apoptosis

in Medicinal and Pharmaceutical Chemistry

Zhihong Hu
Xixi Hou
Yongjing Ren
Ziyuan Wu
Dong Yan
Hong Chen
Lan Wang

Frontiers in Chemistry

doi 10.3389/fchem.2025.1456743

606 views

Original Research

Published on 23 Jan 2025

Microbial-based natural products as potential inhibitors targeting DNA gyrase B of Mycobacterium tuberculosis: an in silico study

in Medicinal and Pharmaceutical Chemistry

Tilal Elsaman
Magdi Awadalla Mohamed
Malik Suliman Mohamed
Eyman Mohamed Eltayib
Abualgasim Elgaili Abdalla

Frontiers in Chemistry

doi 10.3389/fchem.2025.1524607

813 views

Original Research

Published on 20 Jan 2025

Discovery of novel PRMT1 inhibitors: a combined approach using AI classification model and traditional virtual screening

in Medicinal and Pharmaceutical Chemistry

Jungan Zhang
Yixin Ren
Yun Teng
Han Wu
Jingsu Xue
Lulu Chen
Xiaoyue Song
Yan Li
Ying Zhou
Zongran Pang

Frontiers in Chemistry

doi 10.3389/fchem.2025.1548812

623 views

Original Research

Published on 17 Jan 2025

In silico identification of the anticataract target of βB2-crystallin from Phaseolus vulgaris: a new insight into cataract treatment

in Medicinal and Pharmaceutical Chemistry

Sunday Amos Onikanni
Adewale Oluwaseun Fadaka
Tran Nhat Phong Dao
Valens Munyembaraga
Vincent Nyau
Nicole Remaliah Samantha Sibuyi
Morenike Grace Ajayi
Nguyen Thi Ai Nhung
Emmanuel Ejiofor
Basiru Olaitan Ajiboye

Frontiers in Chemistry

doi 10.3389/fchem.2024.1421534

748 views

Original Research

Published on 16 Jan 2025

Exploring the potential of some natural indoles as antiviral agents: quantum chemical analysis, inverse molecular docking, and affinity calculations

in Medicinal and Pharmaceutical Chemistry

Amany Belal
Aly Abdou
Samar F. Miski
Mohamed A. M. Ali
Heba I. Ghamry
Ahmad J. Obaidullah
Mohamed Y. Zaky
Ahmed H. E. Hassan
Eun Joo Roh
Ahmed A. Al-Karmalawy

Frontiers in Chemistry

doi 10.3389/fchem.2024.1521298

823 views

Original Research

Published on 15 Jan 2025

Syzygium aromaticum extract mediated, sustainable silver nanoparticle synergetic with heterocyclic antibiotic clarithromycin and their antimicrobial activities

in Medicinal and Pharmaceutical Chemistry

Zehra Edis
Samir Haj Bloukh
Akram A. Ashames
Moawia M. Al-Tabakha
Moyad J. S. A. Shahwan
Hamed Abu Sara
Sai H. S. Boddu
Sohaib N. Khan
Ibrahim Haj Bloukh
Maram Eladdasy

Frontiers in Chemistry

doi 10.3389/fchem.2024.1513150

884 views

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Articles

Anti-proliferative effects of a polyherbal formulation on HL-60, HCT-116, and HeLa cell lines: a docking simulation and response surface design-aided study

Antioxidant Activity and Selective Cytotoxicity in HCT-116 and WI-38 cell Lines of LC-MS/MS profiled extract from Capparis spinosa L

Design, synthesis, and in vitro, in vivo, and in silico evaluation of novel substituted 1,3,4-thiadiazole derivatives as anticonvulsant agents

Composite Nanoparticles-based Vesicles Achieve Enhanced Delivery Effect of the Natural Plant Extract of Root, Stem, and Fruit

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

Molecular characterization, chemical profile and biological properties of essential oils from Chamaemelum nobile (L.) flowers of Morocco: in vitro and in silico studies

Editorial: Exploring novel approaches to small molecule kinase inhibitors in cancer treatment

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

4-Aminoquinoline as a privileged scaffold for the design of leishmanicidal agents: structure–property relationships and key biological targets

Bis(7)-harmine derivatives as potential multi-target anti-Alzheimer agents

Anti-cancer activity of synthetic gefitinib-1,2,3-triazole derivatives against Hela cells via induction of apoptosis

Microbial-based natural products as potential inhibitors targeting DNA gyrase B of Mycobacterium tuberculosis: an in silico study

Discovery of novel PRMT1 inhibitors: a combined approach using AI classification model and traditional virtual screening

In silico identification of the anticataract target of βB2-crystallin from Phaseolus vulgaris: a new insight into cataract treatment

Exploring the potential of some natural indoles as antiviral agents: quantum chemical analysis, inverse molecular docking, and affinity calculations

Syzygium aromaticum extract mediated, sustainable silver nanoparticle synergetic with heterocyclic antibiotic clarithromycin and their antimicrobial activities