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Author

M. T. Muhammed

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4 papers indexed here

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Sep 2026

Structure-Based Virtual Screening and Computational Evaluation of Putative Mushroom-Associated Natural Compounds as Janus Kinase 1 (JAK1) Inhibitors: An In Silico Study.

INTRODUCTION/OBJECTIVE Janus kinase 1 (JAK1) is a key controller and regulator of cytokinemediated immune responses and an effective therapeutic target in autoimmune and inflammatory diseases. In the present study, an in silico workflow was implemented to identify secondary metabolites of mushrooms as prospective JAK1-...

Bushra Shakoor, Ali Irfan, M. Muhammed et al. · 0 citations
Open access Sep 2026

Exploring benzofuran derivatives as selective MAO-B inhibitors: a multilayered in silico study

A total of thirty-seven benzofuran derivatives were analyzed as potential monoamine oxidase B (MAO-B) inhibitors using a variety of computational methods, including extra-precision docking, induced-fit docking (IFD), molecular mechanics/generalized Born surface area (MM/GBSA) re-scoring, ChemPLP re-docking, molecular...

E. Mateev, Ali Irfan, Stefan Kostov et al. · 0 citations
Open access Aug 2026

Sulfonamide‐Based 2‐Amino‐1,3,4‐Oxadiazole Derivatives as Dual Cholinesterase and Carbonic Anhydrase Inhibitors: Design, Synthesis, Kinetic Characterization, Molecular Modeling, and ADMET Evaluation

The synthesized sulfonamide derivatives are identified as promising scaffolds for the further development of multifunctional cholinesterase and carbonic anhydrase inhibitors and potential limitations associated with higher polarity, limited predicted blood–brain barrier penetration, and predicted toxicity risks are ide...

Gülnur Arslan Karahan, Başak Gökçe, M. T. Muhammed et al. · 0 citations
Open access Sep 2026

Synthesis, Biological Evaluation, and In Silico Studies of Naphtalene‐Hydrazide Derivatives as Dual‐Action Agents for Alzheimer's Disease: Targeting BChE and Oxidative Stress

Interestingly, compounds 7a and 8a exhibited five‐fold higher selectivity for BChE than AChE, suggesting their potential relevance for further exploration in the context of Alzheimer's disease therapeutics.

Dilan Konyar, Hayati Okur, M. T. Muhammed et al. · 0 citations

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