Cargando…

Identification of potential SARS-CoV-2 entry inhibitors by targeting the interface region between the spike RBD and human ACE2

Coronavirus disease 2019 (COVID-19) is a fatal infectious disease caused by severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2). The virus infection is initiated upon recognition and binding of the spike (S) protein receptor-binding domain (RBD) to the host cell surface receptor, angiotensi...

Descripción completa

Detalles Bibliográficos
Autores principales:	Gurung, Arun Bahadur, Ali, Mohammad Ajmal, Lee, Joongku, Farah, Mohammad Abul, Al-Anazi, Khalid Mashay
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Author(s). Published by Elsevier Ltd on behalf of King Saud Bin Abdulaziz University for Health Sciences. 2021
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7752028/ https://www.ncbi.nlm.nih.gov/pubmed/33493919 http://dx.doi.org/10.1016/j.jiph.2020.12.014

Ejemplares similares

Structural and functional insights into the major mutations of SARS-CoV-2 Spike RBD and its interaction with human ACE2 receptor
por: Gurung, Arun Bahadur, et al.
Publicado: (2022)

The potential of Paritaprevir and Emetine as inhibitors of SARS-CoV-2 RdRp
por: Gurung, Arun Bahadur, et al.
Publicado: (2021)

Unravelling lead antiviral phytochemicals for the inhibition of SARS-CoV-2 M(pro) enzyme through in silico approach
por: Gurung, Arun Bahadur, et al.
Publicado: (2020)

In silico screening of FDA approved drugs reveals ergotamine and dihydroergotamine as potential coronavirus main protease enzyme inhibitors
por: Gurung, Arun Bahadur, et al.
Publicado: (2020)

Structure-based virtual screening of phytochemicals and repurposing of FDA approved antiviral drugs unravels lead molecules as potential inhibitors of coronavirus 3C-like protease enzyme
por: Bahadur Gurung, Arun, et al.
Publicado: (2020)

An Updated Review of Computer-Aided Drug Design and Its Application to COVID-19
por: Gurung, Arun Bahadur, et al.
Publicado: (2021)

Molecular docking and dynamics simulation study of bioactive compounds from Ficus carica L. with important anticancer drug targets
por: Gurung, Arun Bahadur, et al.
Publicado: (2021)

Identification of SARS-CoV-2 inhibitors from extracts of Houttuynia cordata Thunb.
por: Bahadur Gurung, Arun, et al.
Publicado: (2021)

Artesunate induces substantial topological alterations in the SARS-CoV-2 Nsp1 protein structure
por: Gurung, Arun Bahadur, et al.
Publicado: (2022)

Molecular modelling studies unveil potential binding sites on human serum albumin for selected experimental and in silico COVID-19 drug candidate molecules
por: Gurung, Arun Bahadur, et al.
Publicado: (2022)

Molecular docking elucidates the plausible mechanisms underlying the anticancer properties of acetyldigitoxigenin from Adenium obesum
por: Gurung, Arun Bahadur, et al.
Publicado: (2020)

Transcriptome characterization of Larrea tridentata and identification of genes associated with phenylpropanoid metabolic pathways
por: Ali, Mohammad Ajmal, et al.
Publicado: (2022)

The cp genome characterization of Adenium obesum: Gene content, repeat organization and phylogeny
por: Alanazi, Khalid Mashay, et al.
Publicado: (2021)

Exploring the phytochemicals of Platycodon grandiflorus for TMPRSS2 inhibition in the search for SARS-CoV-2 entry inhibitors
por: Gurung, Arun Bahadur, et al.
Publicado: (2022)

Plastome data analysis of Cucumis melo subsp.agrestis
por: Ajmal Ali, Mohammad, et al.
Publicado: (2021)

Plastome of Saraca asoca (Detarioideae, Fabaceae): Annotation, comparison among subfamily and molecular typing
por: Ali, Mohammad Ajmal, et al.
Publicado: (2021)

The binding proximity of methyl β-lilacinobioside isolated from Caralluma retrospiciens with topoisomerase II attributes apoptosis in breast cancer cell line
por: Alallah, Mohammad Ibrahim, et al.
Publicado: (2018)

Comparative plastome data analysis of Dendrosicyos socotranus and Corallocarpus boehmii
por: Ali, Mohammad Ajmal, et al.
Publicado: (2021)

Role of tannic acid against SARS-cov-2 cell entry by targeting the interface region between S-protein-RBD and human ACE2
por: Chen, Xi, et al.
Publicado: (2022)

An in silico approach unveils the potential of antiviral compounds in preclinical and clinical trials as SARS-CoV-2 omicron inhibitors
por: Bahadur Gurung, Arun, et al.
Publicado: (2022)

In silico analyses of major active constituents of fingerroot (Boesenbergia rotunda) unveils inhibitory activities against SARS-CoV-2 main protease enzyme
por: Bahadur Gurung, Arun, et al.
Publicado: (2022)

Integrative approach for validation of six important fish species inhabiting River Poonch of north-west Himalayan region (India)
por: Awas, Mohd, et al.
Publicado: (2023)

Indexing hematological and serum biochemical reference intervals of Himalayan snow trout, Schizothorax esocinus to instrument in health assessment
por: Reshi, Quseen Mushtaq, et al.
Publicado: (2023)

Can polyoxometalates (POMs) prevent of coronavirus 2019-nCoV cell entry? Interaction of POMs with TMPRSS2 and spike receptor domain complexed with ACE2 (ACE2-RBD): Virtual screening approaches
por: Shahabadi, Nahid, et al.
Publicado: (2022)

Geraniin Inhibits the Entry of SARS-CoV-2 by Blocking the Interaction between Spike Protein RBD and Human ACE2 Receptor
por: Kim, Young Soo, et al.
Publicado: (2021)

Effect of Delta and Omicron Mutations on the RBD-SD1 Domain of the Spike Protein in SARS-CoV-2 and the Omicron Mutations on RBD-ACE2 Interface Complex
por: Ching, Wai-Yim, et al.
Publicado: (2022)

Reactive Oxygen Species-Mediated Cytotoxicity in Liver Carcinoma Cells Induced by Silver Nanoparticles Biosynthesized Using Schinus molle Extract
por: Hailan, Waleed Ali, et al.
Publicado: (2022)

Bioremediation of Cadmium Toxicity in Wheat (Triticum aestivum L.) Plants Primed with L-Proline, Bacillus subtilis and Aspergillus niger
por: Bashir, Sarmad, et al.
Publicado: (2022)

Potential of antiviral peptide-based SARS-CoV-2 inactivators to combat COVID-19
por: Gurung, Arun Bahadur, et al.
Publicado: (2022)

The Development of Pharmacophore Models for the Search of New Natural Inhibitors of SARS-CoV-2 Spike RBD–ACE2 Binding Interface
por: Semenov, Valentin A., et al.
Publicado: (2022)

Comprehensive exploration of the anticancer activities of procaine and its binding with calf thymus DNA: a multi spectroscopic and molecular modelling study
por: Ali, Mohd. Sajid, et al.
Publicado: (2018)

Multi-Targeted Approaches and Drug Repurposing Reveal Possible SARS-CoV-2 Inhibitors
por: Alanazi, Khalid Mashay, et al.
Publicado: (2021)

Maternal and developmental toxicity of Bisphenol-A in SWR/J mice
por: Mashay Al-Anazi, Khalid, et al.
Publicado: (2022)

Masitinib analogues with the N-methylpiperazine group replaced – A new hope for the development of anti-COVID-19 drugs
por: Gurung, Arun Bahadur, et al.
Publicado: (2023)

Fluorescent delivery vehicle containing cobalt oxide–umbelliferone nanoconjugate: DNA/protein interaction studies and anticancer activity on MF7 cancer cell line
por: Ali, Mohd Sajid, et al.
Publicado: (2019)

Complete chloroplast genome of vulnerable medicinal plant Saraca asoca (Fabaceae)
por: Ali, Mohammad Ajmal, et al.
Publicado: (2020)

Peptide modelling and screening against human ACE2 and spike glycoprotein RBD of SARS-CoV-2
por: Rathod, Shravan B., et al.
Publicado: (2020)

Biomechanical characterization of SARS-CoV-2 spike RBD and human ACE2 protein-protein interaction
por: Cao, Wenpeng, et al.
Publicado: (2021)

A Collection of Designed Peptides to Target SARS-CoV-2 Spike RBD—ACE2 Interaction
por: Fernandez-Fuentes, Narcis, et al.
Publicado: (2021)

Differential Interactions Between Human ACE2 and Spike RBD of SARS-CoV-2 Variants of Concern
por: Kim, Seonghan, et al.
Publicado: (2021)

Cannot write session to /tmp/vufind_sessions/sess_ht2lipsqhg7t9se356a9mndrla