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BioImpacts. 2021;11(2): 119-127. doi: 10.34172/bi.2021.19
PMID: 33842282        PMCID: PMC8022237

Original Research

In silico approach towards the identification of potential inhibitors from Curcuma amada Roxb against H. pylori: ADMET screening and molecular docking studies

G Divyashri 1 * ORCID, T P Krishna Murthy 1, Subramaniam Sundareshan 1, Pavan Kamath 1, Manikanta Murahari 2,3 * , G R Saraswathy 2,4, Bindu Sadanandan 1

Cited by CrossRef: 16

1- Dhanalakshmi M, Pandya M, Sruthi D, Jinuraj K, Das K, Gadnayak A, Dave S, Andal N. The artificial neural network selects saccharides from natural sources a promise for potential FimH inhibitor to prevent UTI infections. In Silico Pharmacol. 2024;12(1) [Crossref]
2- Almeida A, Marchiosi R, Abrahão J, Constantin R, dos Santos W, Ferrarese-Filho O. Revisiting the shikimate pathway and highlighting their enzyme inhibitors. Phytochem Rev. 2024;23(2):421 [Crossref]
3- Rao S, Shetty N. Structure-based screening of natural product libraries in search of potential antiviral drug-leads as first-line treatment to COVID-19 infection. Microbial Pathogenesis. 2022;165:105497 [Crossref]
4- Saeed M, Eghdami A. Inhibitory effect of herbal compounds on the Oxygen-insensitive NADPH nitro reductase enzyme of metronidazole-resistant Helicobacter pylori . sciphy. 2023;2(1):98 [Crossref]
5- Thamaraikani T, Anandan V, Karnam M, Vasanthan M, Kichenamurthy G. In silico Evaluation and Neuroprotective Effect of Jasmonic Acid on Sleep Deprivation Induced Alzheimer’s in Zebrafish. CBC. 2023;19(7) [Crossref]
6- Shehab W, Elsayed D, Abdel Hamid A, Assy M, Mouneir S, Hamed E, Mousa S, El-Bassyouni G. CuO nanoparticles for green synthesis of significant anti-Helicobacter pylori compounds with in silico studies. Sci Rep. 2024;14(1) [Crossref]
7- Khatoon N, Alam Z, Hussain I, Khubaib B, Javed M, Ali Q. Comprehensive analysis of Seriphidium kurramense: GC/MS profiling, antibacterial and antibiofilm activities, molecular docking study and in-silico ADME profiling. Discov Appl Sci. 2024;6(3) [Crossref]
8- Chitre T, Bhatambrekar A, Hirode P, Thorat S, Hajare S, Garud D, Jagdale S, Asgaonkar K. A Combination of Pharmacophore Generation, Ligand-based Virtual Screening, Atom-based 3D-QSAR, and Molecular Docking Studies on Febuxostat-based Amides Analogues as Anti-inflammatory Agents. CDDT. 2025;22(1) [Crossref]
9- Selvaraj L, Thayumanavan G, Jeyabalan S, Jabaris S. Molecular Docking Studies of Phytoconstituents Identified in Traditional Siddha Polyherbal Formulations Against Possible Targets of SARS-CoV-2. J Mol Docking. 2021;1(1):15 [Crossref]
10- Noori Goodarzi N, Khazani Asforooshani M, Shahbazi B, Rezaie Rahimi N, Badmasti F. Identification of novel drug targets for Helicobacter pylori: structure-based virtual screening of potential inhibitors against DAH7PS protein involved in the shikimate pathway. Front Bioinform. 2024;4 [Crossref]
11- Narayanankutty A, Sasidharan A, Job J, Rajagopal R, Alfarhan A, Kim Y, Kim H. Mango ginger (Curcuma amada Roxb.) rhizome essential oils as source of environmental friendly biocides: Comparison of the chemical composition, antibacterial, insecticidal and larvicidal properties of essential oils extracted by different methods. Environmental Research. 2021;202:111718 [Crossref]
12- Osunleti S, Lagoke S. Response of mango ginger (Curcuma amada) to plant population and different weed control methods in the forest-savanna transition zone of south-western Nigeria. J Agric Sci BGD. 2024;69(2):155 [Crossref]
13- Malkaje S, Srinivasa M, Deshpande N S, Navada S, Navada R. An In-silico Approach: Design, Homology Modeling, Molecular Docking, MM/GBSA Simulations, and ADMET Screening of Novel 1,3,4-oxadiazoles as PLK1inhibitors. CDRR. 2023;15(1):88 [Crossref]
14- Tharamelveliyil Rajendran A, Dheeraj Rajesh G, Kumar P, Shivam Raju Dwivedi P, Shashidhara Shastry C, Narayanan Vadakkepushpakath A. Selection of potential natural compounds for poly-ADP-ribose polymerase (PARP) inhibition in glioblastoma therapy by in silico screening methods. Saudi Journal of Biological Sciences. 2023;30(7):103698 [Crossref]
15- Al-Rajhi A, Qanash H, Bazaid A, Binsaleh N, Abdelghany T. Pharmacological Evaluation of Acacia nilotica Flower Extract against Helicobacter pylori and Human Hepatocellular Carcinoma In Vitro and In Silico. JFB. 2023;14(4):237 [Crossref]
16- Thamaraikani T, Karnam M, Velapandian C. In Silico Docking of Novel Phytoalkaloid Camalexin in the Management of Benomyl Induced Parkinson's Disease and its In Vivo Evaluation by Zebrafish Model. CNSNDDT. 2022;21(4):343 [Crossref]

As a peer-reviewed international open-access journal, BioImpacts publishes articles on basic and translational aspects of pharmaceutical and biomedical sciences. 
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