FDA-approved trifluoromethyl group-containing drugs: a review of 20 years AS Nair, AK Singh, A Kumar, S Kumar, S Sukumaran, VP Koyiparambath, ... Processes 10 (10), 2054, 2022 | 106 | 2022 |
Deciphering the detailed structure–activity relationship of coumarins as Monoamine oxidase enzyme inhibitors—An updated review VP Koyiparambath, K Prayaga Rajappan, TM Rangarajan, AG Al‐Sehemi, ... Chemical biology & drug design 98 (4), 655-673, 2021 | 44 | 2021 |
Development of bromo-and fluoro-based α, β-unsaturated ketones as highly potent MAO-B inhibitors for the treatment of Parkinson's disease MA Abdelgawad, JM Oh, DGT Parambi, S Kumar, A Musa, MM Ghoneim, ... Journal of Molecular Structure 1266, 133545, 2022 | 41 | 2022 |
Exploiting cheminformatic and machine learning to navigate the available chemical space of potential small molecule inhibitors of SARS-CoV-2 A Kumar, S Loharch, S Kumar, RP Ringe, R Parkesh Computational and structural biotechnology journal 19, 424-438, 2021 | 37 | 2021 |
Exploration of the detailed structure–activity relationships of isatin and their isomers as monoamine oxidase inhibitors S Kumar, AS Nair, MA Abdelgawad, B Mathew ACS omega 7 (19), 16244-16259, 2022 | 31 | 2022 |
Introduction of benzyloxy pharmacophore into aryl/heteroaryl chalcone motifs as a new class of monoamine oxidase B inhibitors ST Sudevan, JM Oh, MA Abdelgawad, MAS Abourehab, TM Rangarajan, ... Scientific reports 12 (1), 22404, 2022 | 27 | 2022 |
Development of isopropyl-tailed chalcones as a new class of selective MAO-B inhibitors for the treatment of Parkinson’s disorder S Kumar, JM Oh, MA Abdelgawad, MAS Abourehab, AK Tengli, AK Singh, ... ACS omega 8 (7), 6908-6917, 2023 | 26 | 2023 |
Chemical space exploration of DprE1 inhibitors using chemoinformatics and artificial intelligence S Chhabra, S Kumar, R Parkesh ACS omega 6 (22), 14430-14441, 2021 | 23 | 2021 |
Conjugated dienones from differently substituted cinnamaldehyde as highly potent monoamine oxidase-B inhibitors: Synthesis, biochemistry, and computational chemistry B Mathew, JM Oh, MA Abdelgawad, A Khames, MM Ghoneim, S Kumar, ... ACS omega 7 (9), 8184-8197, 2022 | 19 | 2022 |
Development of halogenated pyrazolines as selective monoamine oxidase-B Inhibitors: Deciphering via molecular dynamics approach AS Nair, JM Oh, VP Koyiparambath, S Kumar, ST Sudevan, O Soremekun, ... Molecules 26 (11), 3264, 2021 | 18 | 2021 |
Navigating into the chemical space of monoamine oxidase inhibitors by artificial intelligence and cheminformatics approach S Kumar, AS Nair, V Bhashkar, ST Sudevan, VP Koyiparambath, ... ACS omega 6 (36), 23399-23411, 2021 | 16 | 2021 |
Piperidine: A Versatile Heterocyclic Ring for Developing Monoamine Oxidase Inhibitors J Jayan, N Chandran, AC Thekkantavida, MA Abdelgawad, MM Ghoneim, ... ACS omega 8 (41), 37731-37751, 2023 | 14 | 2023 |
Aldoxime-and hydroxy-functionalized chalcones as highly potent and selective monoamine oxidase-B inhibitors JM Oh, TM Rangarajan, R Chaudhary, N Gambacorta, O Nicolotti, ... Journal of Molecular Structure 1250, 131817, 2022 | 14 | 2022 |
Isatin-tethered halogen-containing acylhydrazone derivatives as monoamine oxidase inhibitor with neuroprotective effect S Kumar, JM Oh, P Prabhakaran, A Awasti, H Kim, B Mathew Scientific Reports 14 (1), 1264, 2024 | 13 | 2024 |
Review of β‐carboline and its derivatives as selective MAO‐A inhibitors F Benny, S Kumar, J Jayan, MA Abdelgawad, MM Ghoneim, A Kumar, ... Archiv der Pharmazie 356 (7), 2300091, 2023 | 13 | 2023 |
Current and future nano-carrier-based approaches in the treatment of Alzheimer’s disease A Kumar, ST Sudevan, AS Nair, AK Singh, S Kumar, J Jose, T Behl, ... Brain Sciences 13 (2), 213, 2023 | 13 | 2023 |
“Click Chemistry”: An Emerging Tool for Developing a New Class of Structural Motifs against Various Neurodegenerative Disorders A Manoharan, J Jayan, TM Rangarajan, K Bose, F Benny, RS Ipe, ... ACS omega 8 (47), 44437-44457, 2023 | 12 | 2023 |
A structural approach to investigate halogen substituted MAO-B inhibitors using QSAR modeling, molecular dynamics, and conceptual DFT analysis N Maliyakkal, I Ahmad, S Kumar, ST Sudevan, AA Beeran, H Patel, H Kim, ... Journal of Saudi Chemical Society 27 (4), 101675, 2023 | 12 | 2023 |
Discerning of isatin-based monoamine oxidase (MAO) inhibitors for neurodegenerative disorders by exploiting 2D, 3D-QSAR modelling and molecular dynamics simulation S Kumar, J Jayan, A Manoharan, F Benny, MA Abdelgawad, ... Journal of Biomolecular Structure and Dynamics 42 (5), 2328-2340, 2024 | 10 | 2024 |
A structure-based approach to explore novel COX-2 inhibitors using pharmacophore modelling, 3D-QSAR analysis, virtual screening and dynamics simulation study PR Krishnendu, S Benny, S Kumar, J Jayan, V Bhaskar, LK Pappachen, ... Journal of Molecular Structure 1295, 136634, 2024 | 9 | 2024 |