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Nitin Deshmukh

Publications (5)

Structure-based in silico Screening, ADMET Prediction, and Molecular Docking of Novel Benzylidene-3,4,5-Trihydroxybenzohydrazide and Phenylamino Benzene-triol Derivatives Targeting Tyrosine Kinase for Anticancer Activity

Nitin Deshmukh, Prabhat Kumar Das, Priyanka Kumawat, Pragati Kushwah, Jayshree Dhangar, Saniya Karma & Shruti Yadav · Journal of Complementary and Alternative Medical Research · 2026

Background: Lung cancer is one of the most common and deadliest cancers worldwide, contributing significantly to cancer-related morbidity and mortality. Ongoing research in this field focuses on the development of effective preventive strategies, early screening methods, and impr...

Open access Research Article 10.9734/jocamr/2026/v27i2739

Computational Exploration of 4-Hydroxy-3-Methoxycinnamic Acid Derivatives Derived from Natural Product Scaffolds for Anticancer Activity

Nitin Deshmukh, Prabhat Kumar Das, Saniya Karma, Viraj Aachary, Shruti Yadav & Priyanka Kumawat · International Journal of Biochemistry Research & Review · 2026

Objective: This study seeks to investigate 4-hydroxy-3-methoxycinnamic acid (Ferulic acid) derivatives using computational approaches—specifically Lipinski’s Rule of Five, ADMET profiling, Mol-Inspiration analysis, and molecular docking—in order to evaluate their drug-likeness, p...

Open access Research Article 10.9734/ijbcrr/2026/v35i21100

Computational Design and Molecular Docking Study of Structurally Modified Gallic Acid Derivatives

Nitin Deshmukh, Prabhat Kumar Das, Mayank Laad, Khushi Bhawsar & Pranjal Patidar · Journal of Complementary and Alternative Medical Research · 2026

This study evaluates the anticancer potential of phytochemical constituents derived from Bougainvillea glabra, with a specific focus on Gallic acid derivatives synthesized using aromatic aldehydes and aromatic amines through an in silico molecular docking strategy. The shade-drie...

Open access Research Article 10.9734/jocamr/2026/v27i1734

Epigenetics, Neuropharmacology, and Biochemical Modifications in Brain Disorders: Molecular Mechanisms and Therapeutic Perspectives

Nitin Deshmukh, Prabhat Kumar Das, Ruchita Raghuwanshi, Prakhar Soni & Mohini Patidar · Asian Journal of Advanced Research and Reports · 2026

Brain disorders represent a major global health burden, encompassing neurodegenerative, neuropsychiatric, and neurodevelopmental conditions. Increasing evidence highlights the crucial roles of epigenetic regulation, neuropharmacological mechanisms, and biochemical modifications i...

Open access Research Article 10.9734/ajarr/2026/v20i11268

In Silico Investigation of 4-hydroxy-3-Methoxycinnamic Acid Derivatives as Inhibitors of Key Oncogenic Targets Using Molecular Docking and ADMET Analysis

Prabhat Kumar Das, Nitin Deshmukh, Saniya Karma, Viraj Aachary, Shruti Yadav & Priyanka Kumawat · Asian Journal of Advanced Research and Reports · 2026

Objective: This study aims to evaluate derivative of 4-hydroxy-3-methoxycinnamic acid through computational methods, including Lipinski’s Rule of Five, ADMET prediction, Mol-inspiration analysis and molecular docking to assess its drug-likeness, pharmacokinetics, and therapeutic...

Open access Research Article 10.9734/ajarr/2026/v20i21288