Bijo Mathew
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View article: Morin Modulates Key Targets and Pathways Associated with Gastric Cancer: Network Pharmacology, Molecular Docking, Molecular Dynamics, ADMET, and In‑Vitro Analysis
Morin Modulates Key Targets and Pathways Associated with Gastric Cancer: Network Pharmacology, Molecular Docking, Molecular Dynamics, ADMET, and In‑Vitro Analysis Open
Gastric cancer (GC), widely known as stomach cancer, is a critical health concern across the world. It ranks among the world’s five most common cancer types and is third in terms of fatalities from tumour disease. Natural products have bee…
View article: Formulation and Evaluation of Transdermal Patches from Peperomia Pellucida for Anti-Inflammatory Activity
Formulation and Evaluation of Transdermal Patches from Peperomia Pellucida for Anti-Inflammatory Activity Open
Peperomia pellucida is one of the significant plant found through out India, and has a wide range of ethno medical uses. It is widely used in Siddha, Ayurveda, Unani, and other traditional medicinal systems. Many secondary metabolites foun…
View article: Morpholino Pyridazinone Derivatives as Selective Mao-B Inhibitors
Morpholino Pyridazinone Derivatives as Selective Mao-B Inhibitors Open
View article: Inhibition of monoamine oxidase by fluorobenzyloxy chalcone derivatives
Inhibition of monoamine oxidase by fluorobenzyloxy chalcone derivatives Open
Inhibition of monoamine oxidase-B (MAO-B) decelerates the breakdown of dopamine in the brain, consequently augmenting dopaminergic neurotransmission, which is a critical pathway for ameliorating motor symptomatology of Parkinson's disease …
View article: Synthetic strategies and medicinal chemistry perspectives of dual acting carbonic anhydrase modulators with monoamine oxidase and cholinesterase inhibitors
Synthetic strategies and medicinal chemistry perspectives of dual acting carbonic anhydrase modulators with monoamine oxidase and cholinesterase inhibitors Open
Dual acting carbonic anhydrase modulators with monoamine oxidase and cholinesterase inhibitors.
View article: Design, synthesis, <i>in vitro</i>, and <i>in silico</i> studies of novel isatin-hybrid hydrazones as potential triple-negative breast cancer agents
Design, synthesis, <i>in vitro</i>, and <i>in silico</i> studies of novel isatin-hybrid hydrazones as potential triple-negative breast cancer agents Open
Recent advances in cancer therapy have been made possible by monoclonal antibodies, domain antibodies, antibody drug conjugates, etc.
View article: Essential Oil-Mediated Bulk and Surface Engineering of Biomolecule-Metal Nanocomposites for Biomedical Applications
Essential Oil-Mediated Bulk and Surface Engineering of Biomolecule-Metal Nanocomposites for Biomedical Applications Open
View article: Potent Antimicrobial Azoles: Synthesis, In Vitro and In Silico Study
Potent Antimicrobial Azoles: Synthesis, In Vitro and In Silico Study Open
Background/Objectives: The increase in fungal infections, both systemic and invasive, is a major source of morbidity and mortality, particularly among immunocompromised people such as cancer patients and organ transplant recipients. Becaus…
View article: Recent Progress in Synthetic and Natural Catechol-<i>O</i>-methyltransferase Inhibitors for Neurological Disorders
Recent Progress in Synthetic and Natural Catechol-<i>O</i>-methyltransferase Inhibitors for Neurological Disorders Open
Catechol-O-methyltransferase (COMT) inhibitors have played a crucial role in the development of potent and selective drugs for the treatment of Parkinson's disease, depression, and anxiety disorders. This review provides a comprehen…
View article: Inhibition of monoamine oxidases by heterocyclic derived conjugated dienones: synthesis and <i>in vitro</i> and <i>in silico</i> investigations
Inhibition of monoamine oxidases by heterocyclic derived conjugated dienones: synthesis and <i>in vitro</i> and <i>in silico</i> investigations Open
A total of 18 heterocyclic derived conjugated dienones (CD1–CD18) were evaluated for their potential monoamine oxidase (MAO)-A/-B inhibitory activity.
View article: Elucidating molecular mechanism and chemical space of chalcones through biological networks and machine learning approaches
Elucidating molecular mechanism and chemical space of chalcones through biological networks and machine learning approaches Open
We developed a bio-cheminformatics method, exploring disease inhibition mechanisms using machine learning-enhanced quantitative structure-activity relationship (ML-QSAR) models and knowledge-driven neural networks. ML-QSAR models were deve…
View article: Multireceptor Analysis for Evaluating the Antidiabetic Efficacy of Karanjin: A Computational Approach
Multireceptor Analysis for Evaluating the Antidiabetic Efficacy of Karanjin: A Computational Approach Open
Background Diabetes mellitus, notably type 2, is a rising global health challenge, prompting the need for effective management strategies. Common medications such as metformin, insulin, repaglinide and sitagliptin can induce side effects l…
View article: Inhibition of Monoamine Oxidases by Pyridazinobenzylpiperidine Derivatives
Inhibition of Monoamine Oxidases by Pyridazinobenzylpiperidine Derivatives Open
Monoamine oxidase inhibitors (MAOIs) have been crucial in the search for anti-neurodegenerative medications and continued to be a vital source of molecular and mechanistic diversity. Therefore, the search for selective MAOIs is one of the …
View article: Design and Synthesis of the Linezolid Bioisosteres to Resolve the Serotonergic Toxicity Associated with Linezolid
Design and Synthesis of the Linezolid Bioisosteres to Resolve the Serotonergic Toxicity Associated with Linezolid Open
Serotonergic toxicity due to MAO enzyme inhibition is a significant concern when using linezolid to treat MDR-TB. To address this issue, we designed linezolid bioisosteres with a modified acetamidomethyl side chain at the C-5 position of t…
View article: WITHDRAWN: Elucidating the molecular mechanism of phytochemicals against Parkinson’s disease through an integrated systems biology and molecular modeling approach
WITHDRAWN: Elucidating the molecular mechanism of phytochemicals against Parkinson’s disease through an integrated systems biology and molecular modeling approach Open
Withdrawal Statement The authors have withdrawn their manuscript owing to the inability to complete the revisions or follow up on the manuscript at this time, due to personal circumstances. Therefore, the authors do not wish this work to b…
View article: WITHDRAWN: Mechanistic modeling of Mycobacterium tuberculosis β-carbonic anhydrase inhibitors using integrated systems biology and the QSAR approach
WITHDRAWN: Mechanistic modeling of Mycobacterium tuberculosis β-carbonic anhydrase inhibitors using integrated systems biology and the QSAR approach Open
Withdrawal Statement The authors have withdrawn their manuscript owing to the inability to complete the revisions or follow up on the manuscript at this time, due to personal circumstances. Therefore, the authors do not wish this work to b…
View article: Correction to: Targeting cellular batteries for the therapy of neurological diseases
Correction to: Targeting cellular batteries for the therapy of neurological diseases Open
View article: Elucidating Molecular Mechanism and Chemical Space of Chalcones through Knowledge Graph and Machine Learning: A Combined Bio-Cheminformatic Pipeline
Elucidating Molecular Mechanism and Chemical Space of Chalcones through Knowledge Graph and Machine Learning: A Combined Bio-Cheminformatic Pipeline Open
We developed a bio-cheminformatics method, exploring disease inhibition mechanisms using machine learning-enhanced quantitative structure-activity relationship (ML-QSAR) models and knowledge-driven neural networks. ML-QSAR models were deve…
View article: WITHDRAWN: Multimolecular feature-based machine learning: system biology enhanced RF-QSAR modeling for the efficient prediction of the inhibitory potential of diverse SARS CoV-2 3CL Protease inhibitors
WITHDRAWN: Multimolecular feature-based machine learning: system biology enhanced RF-QSAR modeling for the efficient prediction of the inhibitory potential of diverse SARS CoV-2 3CL Protease inhibitors Open
Withdrawal Statement The authors have withdrawn their manuscript owing to the inability to complete the revisions or follow up on the manuscript at this time, due to personal circumstances. Therefore, the authors do not wish this work to b…
View article: Machine learning driven web-based app platform for the discovery of monoamine oxidase B inhibitors
Machine learning driven web-based app platform for the discovery of monoamine oxidase B inhibitors Open
Monoamine oxidases (MAOs), specifically MAO-A and MAO-B, play important roles in the breakdown of monoamine neurotransmitters. Therefore, MAO inhibitors are crucial for treating various neurodegenerative disorders, including Parkinson's di…
View article: Development of morpholine ring-bearing halogenated α,β-unsaturated ketones as selective monoamine oxidase-B inhibitors
Development of morpholine ring-bearing halogenated α,β-unsaturated ketones as selective monoamine oxidase-B inhibitors Open
Nine morpholine-derived halogenated chalcone derivatives ( MHC1 - MHC9 ) were synthesized, and their inhibitory activity against monoamine oxidase (MAO) was evaluated. MHC5 showed the highest inhibitory activity against MAO-B with an IC 50…
View article: Isatin-tethered halogen-containing acylhydrazone derivatives as monoamine oxidase inhibitor with neuroprotective effect
Isatin-tethered halogen-containing acylhydrazone derivatives as monoamine oxidase inhibitor with neuroprotective effect Open
View article: Correction: Isatin-based benzyloxybenzene derivatives as monoamine oxidase inhibitors with neuroprotective effect targeting neurodegenerative disease treatment
Correction: Isatin-based benzyloxybenzene derivatives as monoamine oxidase inhibitors with neuroprotective effect targeting neurodegenerative disease treatment Open
Correction for ‘Isatin-based benzyloxybenzene derivatives as monoamine oxidase inhibitors with neuroprotective effect targeting neurodegenerative disease treatment’ by Feba Benny et al. , RSC Adv. , 2023, 13 , 35240–35250, https://doi.org/…
View article: Design, synthesis, and <i>in vitro</i> and <i>in silico</i> studies of morpholine derived thiazoles as bovine carbonic anhydrase-II inhibitors
Design, synthesis, and <i>in vitro</i> and <i>in silico</i> studies of morpholine derived thiazoles as bovine carbonic anhydrase-II inhibitors Open
Morpholine based thiazoles have been reported as bovine carbonic anhydrase CA-II inhibitors.
View article: FDA-approved drugs containing dimethylamine pharmacophore: a review of the last 50 years
FDA-approved drugs containing dimethylamine pharmacophore: a review of the last 50 years Open
Dimethylamine (DMA) derivatives represent a promising class of compounds with significant potential in the field of medicinal chemistry.
View article: Development of a New Class of Monoamine Oxidase-B Inhibitors by Fine-Tuning the Halogens on the Acylhydrazones
Development of a New Class of Monoamine Oxidase-B Inhibitors by Fine-Tuning the Halogens on the Acylhydrazones Open
A total of 14 acyl hydrazine derivatives (ACH1-ACH14) were developed and examined for their ability to block monoamine oxidase (MAO). Thirteen analogues showed stronger inhibition potency against MAO-B than MAO-A. With a half-maximu…
View article: “Click Chemistry”: An Emerging Tool for Developing a New Class of Structural Motifs against Various Neurodegenerative Disorders
“Click Chemistry”: An Emerging Tool for Developing a New Class of Structural Motifs against Various Neurodegenerative Disorders Open
Click chemistry is a set of easy, atom-economical reactions that are often utilized to combine two desired chemical entities. Click chemistry accelerates lead identification and optimization, reduces the complexity of chemical synthesis, a…
View article: Repurposing Azoles to Resolve Serotogenic Toxicity Associated with Linezolid to Combat Multidrug-Resistant Tuberculosis
Repurposing Azoles to Resolve Serotogenic Toxicity Associated with Linezolid to Combat Multidrug-Resistant Tuberculosis Open
Serotogenic toxicity is a major hurdle associated with Linezolid in the treatment of drug-resistant tuberculosis (TB) due to the inhibition of monoamine oxidase (MAO) enzymes. Azole compounds demonstrate structural similarities to the reco…
View article: A computational investigation of thymidylate synthase inhibitors through a combined approach of 3D-QSAR and pharmacophore modelling
A computational investigation of thymidylate synthase inhibitors through a combined approach of 3D-QSAR and pharmacophore modelling Open
Thymidylate synthase (TS) is a crucial target of cancer drug discovery and is mainly involved in the De novo synthesis of the DNA precursor thymine. In the present study, to generate reliable models and identify a few promising mole…
View article: Inhibitions of monoamine oxidases by ferulic acid hydrazide derivatives: synthesis, biochemistry, and computational evaluation
Inhibitions of monoamine oxidases by ferulic acid hydrazide derivatives: synthesis, biochemistry, and computational evaluation Open
Monoamine oxidases (MAOs) regulate neurotransmitters, and changes in their regulation lead to neurogenerative diseases (NDs). Therefore, MAO inhibitors are used to treat NDs. Ferulic acid, a phenolic compound found in various plant species…