Identification of bioactive molecule from Withania somnifera (Ashwagandha) as SARS-CoV-2 main protease inhibitor

Remdesivir and chloroquine effectively inhibit the recently emerged novel coronavirus (2019-nCoV) in vitro

(2020) Manli Wang et al.   CELL RESEARCH

Learning from the Past: Possible Urgent Prevention and Treatment Options for Severe Acute Respiratory Infections Caused by 2019‐nCoV

(2020) Jared S. Morse et al.   CHEMBIOCHEM

Genomic characterisation and epidemiology of 2019 novel coronavirus: implications for virus origins and receptor binding

(2020) Roujian Lu et al.   LANCET

A pneumonia outbreak associated with a new coronavirus of probable bat origin

(2020) Peng Zhou et al.   NATURE

Transmission routes of 2019-nCoV and controls in dental practice

(2020) Xian Peng et al.   International Journal of Oral Science

An investigation into the identification of potential inhibitors of SARS-CoV-2 main protease using molecular docking study

(2020) Sourav Das et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Peptide-like and small-molecule inhibitors against Covid-19

(2020) Suyash Pant et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Potential inhibitors of coronavirus 3-chymotrypsin-like protease (3CLpro): an in silico screening of alkaloids and terpenoids from African medicinal plants

(2020) Gideon A. Gyebi et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Moroccan Medicinal plants as inhibitors against SARS-CoV-2 main protease: Computational investigations

(2020) I. Aanouz et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Did the hesitancy in declaring COVID-19 a pandemic reflect a need to redefine the term?

(2020) Manfred S Green   LANCET

Structure of Mpro from SARS-CoV-2 and discovery of its inhibitors

(2020) Zhenming Jin et al.   NATURE

Research and Development on Therapeutic Agents and Vaccines for COVID-19 and Related Human Coronavirus Diseases

(2020) Cynthia Liu et al.   ACS Central Science

SARS-CoV-2 and Coronavirus Disease 2019: What We Know So Far

(2020) Firas A. Rabi et al.   Pathogens

Investigation into SARS-CoV-2 Resistance of Compounds in Garlic Essential Oil

(2020) Bui Thi Phuong Thuy et al.   ACS Omega

How Molecular Size Impacts RMSD Applications in Molecular Dynamics Simulations

(2017) Karen Sargsyan et al.   Journal of Chemical Theory and Computation

Comparative study of withanolide production and the related transcriptional responses of biosynthetic genes in fungi elicited cell suspension culture of Withania somnifera in shake flask and bioreactor

(2017) Seema Ahlawat et al.   PLANT PHYSIOLOGY AND BIOCHEMISTRY

Withanone, an Active Constituent from Withania somnifera, Affords Protection Against NMDA-Induced Excitotoxicity in Neuron-Like Cells

(2016) Nawab John Dar et al.   MOLECULAR NEUROBIOLOGY

Silencing of sterol glycosyltransferases modulates the withanolide biosynthesis and leads to compromised basal immunity of Withania somnifera

(2016) Gaurav Singh et al.   Scientific Reports

Withania somnifera Induces Cytotoxic and Cytostatic Effects on Human T Leukemia Cells

(2016) Eleonora Turrini et al.   Toxins

An in silico guided identification of nAChR agonists fromWithania somnifera

(2016) C. Remya et al.   Frontiers in Life Science

Promising Anti-influenza Properties of Active Constituent of Withania somnifera Ayurvedic Herb in Targeting Neuraminidase of H1N1 Influenza: Computational Study

(2015) Zhi Cai et al.   CELL BIOCHEMISTRY AND BIOPHYSICS

Molecular docking and dynamic simulation studies evidenced plausible immunotherapeutic anticancer property by Withaferin A targeting indoleamine 2,3-dioxygenase

(2015) S.V.G. Reddy et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Comparative molecular field analysis and molecular dynamics studies of α/β hydrolase domain containing 6 (ABHD6) inhibitors

(2015) Agnieszka A. Kaczor et al.   JOURNAL OF MOLECULAR MODELING

Withanolide E sensitizes renal carcinoma cells to TRAIL-induced apoptosis by increasing cFLIP degradation

(2015) C J Henrich et al.   Cell Death & Disease

Impaired motor learning attributed to altered AMPA receptor function in the cerebellum of rats with temporal lobe epilepsy: Ameliorating effects of Withania somnifera and withanolide A

(2013) Smijin Soman et al.   EPILEPSY & BEHAVIOR

Withanone as an inhibitor of survivin: A potential drug candidate for cancer therapy

(2013) Varsha P. Wadegaonkar et al.   JOURNAL OF BIOTECHNOLOGY

Withaferin A-related steroids from Withania aristata exhibit potent antiproliferative activity by inducing apoptosis in human tumor cells

(2012) Gabriel G. LLanos et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Screening of promising chemotherapeutic candidates from plants against human adult T-cell leukemia/lymphoma (II): apoptosis of antiproliferactive principle (24,25-dihydrowithanolide D) against ATL cell lines and structure–activity relationships with withanolides isolated from solanaceous plants

(2012) Daisuke Nakano et al.   Journal of Natural Medicines

Temperature-Sensitive Mutants and Revertants in the Coronavirus Nonstructural Protein 5 Protease (3CLpro) Define Residues Involved in Long-Distance Communication and Regulation of Protease Activity

(2012) C. C. Stobart et al.   JOURNAL OF VIROLOGY

Bak Compensated for Bax in p53-null Cells to Release Cytochrome c for the Initiation of Mitochondrial Signaling during Withanolide D-Induced Apoptosis

(2012) Susmita Mondal et al.   PLoS One

Barrier protective effects of withaferin A in HMGB1-induced inflammatory responses in both cellular and animal models

(2012) Wonhwa Lee et al.   TOXICOLOGY AND APPLIED PHARMACOLOGY

Chlorinated withanolides from Withania somnifera

(2011) Xiaoqin Tong et al.   Phytochemistry Letters

Assessing the Performance of the MM/PBSA and MM/GBSA Methods. 1. The Accuracy of Binding Free Energy Calculations Based on Molecular Dynamics Simulations

(2010) Tingjun Hou et al.   Journal of Chemical Information and Modeling

Restoration of stress-induced altered T cell function and corresponding cytokines patterns by Withanolide A

(2009) Kiranjeet Kour et al.   INTERNATIONAL IMMUNOPHARMACOLOGY

Analysis of withanolides in root and leaf ofWithania somnifera by HPLC with photodiode array and evaporative light scattering detection

(2007) Narayan Das Chaurasiya et al.   PHYTOCHEMICAL ANALYSIS