Drug repurposing against SARS-CoV-2 using E-pharmacophore based virtual screening, molecular docking and molecular dynamics with main protease as the target DFCS K. G. Arun,C. S Sharanya,J. Abhithaj Journal of Biomolecular Structure and Dynamics, 2020 | 86* | 2020 |
Repurposing simeprevir, calpain inhibitor IV and a cathepsin F inhibitor against SARS-CoV-2 and insights into their interactions with Mpro. EJV Abhithaj J, Dileep Francis, Sharanya C S, Arun K G , Sadasivan C Journal of Biomolecular Structure & Dynamics, 1-12, 2020 | 30* | 2020 |
Aloe emodin shows high affinity to active site and low affinity to two other sites to result consummately reduced inhibition of lipoxygenase CS Sharanya, KG Arun, A Sabu, M Haridas Prostaglandins & Other Lipid Mediators 150, 106453, 2020 | 15 | 2020 |
Inhibitory activity of hibifolin on adenosine deaminase-experimental and molecular modeling study KG Arun, CS Sharanya, PM Sandeep, C Sadasivan Computational Biology and Chemistry 64, 353-358, 2016 | 14 | 2016 |
Lipoxygenase inhibitory activity of some Sida species due to di (2-ethylhexyl) phthalate DS Preethidan, G Arun, MP Surendran, S Prasanth, A Sabu, C Sadasivan, ... Current Science, 232-237, 2013 | 13 | 2013 |
Bisphenol-A carbonate dimer is a more preferred substrate for laccase mediated degradation than the Biphenol-A in its monomeric and dimeric forms LM Divya, GK Prasanth, KG Arun, C Sadasivan International biodeterioration & biodegradation 135, 19-23, 2018 | 12 | 2018 |
Designing of enzyme inhibitors based on active site specificity: lessons from methyl gallate and its lipoxygenase inhibitory profile S CS, A KG, V V Journal of Receptors and Signal Transduction 38 (3), 256-265, 2018 | 12 | 2018 |
Drug repurposing to identify therapeutics against COVID 19 with SARS-Cov-2 spike glycoprotein and main protease as targets: an in silico study CS Arun kumar G, Sharanya, J Abhithaj, C Sadasivan | 10* | 2020 |
Biochemical and computational insights of adenosine deaminase inhibition by Epigallocatechin gallate KG Arun, CS Sharanya, J Abhithaj, C Sadasivan Computational Biology and Chemistry 83, 107111, 2019 | 10 | 2019 |
Albumin binds to uncoupler CCCP to diminish depolarization of mitochondria G Mahalaxmi, S Ashok, G Arun, G Srinivas Toxicology in Vitro 80, 105325, 2022 | 9 | 2022 |
Computational and experimental validation of morin as adenosine deaminase inhibitor KG Arun, CS Sharanya, C Sadasivan Journal of Receptors and Signal Transduction 38 (3), 240-245, 2018 | 9 | 2018 |
Design, synthesis and SAR studies of novel tacrine derivatives as potent cholinesterase inhibitors B Dogga, EK Reddy, CS Sharanya, J Abhithaj, KG Arun, CSA Kumar, ... European Journal of Medicinal Chemistry Reports 6, 100094, 2022 | 7 | 2022 |
Drug repurposing for COVID-19 from FDA approved and experiment stage drugs by in silico methods with SARS CoV-2 spike protein CS Sharanya, J Abhithaj, A Sabu, H Madathilkovilakathu | 7 | 2020 |
Phycocyanin of marine Oscillatoria sp. inhibits lipoxygenase by protein-protein interaction-induced change of active site entry apace: A model for non-specific biofunctions of … S Prasanth, GK Arun, M Haridas, A Sabu International Journal of Biological Macromolecules 165, 1111-1118, 2020 | 6 | 2020 |
Lipoxygenase inhibitory synthetic derivatives of methyl gallate regulate gene expressions of COX-2 and cytokines to reduce animal model arthritis CS Sharanya, J Abhithaj, KG Arun, KR Eeda, V Bhat, EJ Variyar, A Sabu, ... Scientific Reports 13 (1), 10644, 2023 | 3 | 2023 |
Isozymes inhibited by active site blocking: versatility of calcium indifferent hesperidin binding to phospholipase A2 and its significance J Abhithaj, KG Arun, CS Sharanya, M Haridas, E Jayadevi Variyar Journal of Receptors and Signal Transduction 39 (1), 60-66, 2019 | 3 | 2019 |
Implication of biotransformation of berberine and its derivatives on FtsZ protein: an in silico study DN Chandra, CS Suresh, GA Kumar, PM Sandeep, A Sabu, M Haridas International Journal of Computational Biology and Drug Design 10 (1), 1-11, 2017 | 3 | 2017 |
Landscaping DNA binding potential of piperine derivatives by computational and biophysical methods A Raj, L Vidya, TK Varun, CS Sharanya, J Abhithaj, G Roymahapatra, ... International Journal of Biological Macromolecules 285, 138180, 2025 | 2 | 2025 |
Trypsin is inhibited by phytocompounds liquiritin and terpinen-4-ol from the herb Glycyrrhiza glabra: in vitro and in silico studies J Abhithaj, CS Sharanya, KG Arun, E Jayadevi Variyar, C Sadasivan Journal of Biomolecular Structure and Dynamics 42 (6), 2957-2964, 2024 | 2 | 2024 |
In silico and in vitro validation of some benzimidazole derivatives as adenosine deaminase inhibitors A Kumar G, S CS Indian Journal of Chemistry-Section B (IJC-B) 59 (8), 1175-1182, 2020 | 2 | 2020 |