Discover more insights into Sars Cov 2 3cl

Keywords frequently search together with Sars Cov 2 3cl

Narrow sentence examples with built-in keyword filters

Sars Cov 2 3cl sentence examples within semen armeniacae amarum



The mechanism and active compounds of semen armeniacae amarum treating coronavirus disease 2019 based on network pharmacology and molecular docking


More Sars Cov 2 3cl sentence examples
10.1021/acs.jmedchem.1c01214

Indole Chloropyridinyl Ester-Derived SARS-CoV-2 3CLpro Inhibitors: Enzyme Inhibition, Antiviral Efficacy, Structure–Activity Relationship, and X-ray Structural Studies


More Sars Cov 2 3cl sentence examples
10.1080/14756366.2021.1873977

Scutellaria baicalensis extract and baicalein inhibit replication of SARS-CoV-2 and its 3C-like protease in vitro


More Sars Cov 2 3cl sentence examples
10.1080/07391102.2021.1918256

In a search for potential drug candidates for combating COVID-19: computational study revealed salvianolic acid B as a potential therapeutic targeting 3CLpro and spike proteins.


More Sars Cov 2 3cl sentence examples
10.1101/2021.07.28.454072

BRET-based self-cleaving biosensors for SARS-CoV-2 3CLpro Inhibitor Discovery


More Sars Cov 2 3cl sentence examples
10.26434/CHEMRXIV.14781690.V1

Structure-Guided Design of Conformationally-Constrained Cyclohexane Inhibitors of SARS-CoV-2 3CL Protease


More Sars Cov 2 3cl sentence examples
10.1038/s41467-021-23751-3

Identification of pyrogallol as a warhead in design of covalent inhibitors for the SARS-CoV-2 3CL protease


More Sars Cov 2 3cl sentence examples
10.3390/molecules26175230

GC-MS, LC-MS/MS, Docking and Molecular Dynamics Approaches to Identify Potential SARS-CoV-2 3-Chymotrypsin-Like Protease Inhibitors from Zingiber officinale Roscoe


More Sars Cov 2 3cl sentence examples
10.1016/j.cjac.2021.09.006

Molecular design, molecular docking and ADMET study of cyclic sulfonamide derivatives as SARS-CoV-2 inhibitors


More Sars Cov 2 3cl sentence examples
10.26355/eurrev_202105_25958

Punicalagin and zinc (II) ions inhibit the activity of SARS-CoV-2 3CL-protease in vitro.


More Sars Cov 2 3cl sentence examples
10.1016/j.cyto.2021.155697

SARS-CoV-2 3C-like protease antagonizes interferon-beta production by facilitating the degradation of IRF3


More Sars Cov 2 3cl sentence examples
10.1186/s13020-021-00427-0

The important herbal pair for the treatment of COVID-19 and its possible mechanisms


More Sars Cov 2 3cl sentence examples
10.1101/2021.02.14.431129

ALG-097111, a potent and selective SARS-CoV-2 3-chymotrypsin-like cysteine protease inhibitor exhibits in vivo efficacy in a Syrian Hamster model


More Sars Cov 2 3cl sentence examples
10.1038/s41467-021-22362-2

Lead compounds for the development of SARS-CoV-2 3CL protease inhibitors


More Sars Cov 2 3cl sentence examples
10.33774/CHEMRXIV-2021-TNDBS

Binding and Reactivity of a Nitrile Oral Inhibitor of SARS-CoV-2 Main Protease Revealed by Computational Simulations


More Sars Cov 2 3cl sentence examples
10.1021/acs.jmedchem.1c00665

3CL Protease Inhibitors with an Electrophilic Arylketone Moiety as Anti-SARS-CoV-2 Agents.


More Sars Cov 2 3cl sentence examples
10.3390/molecules26040797

Combining Different Docking Engines and Consensus Strategies to Design and Validate Optimized Virtual Screening Protocols for the SARS-CoV-2 3CL Protease


More Sars Cov 2 3cl sentence examples
10.1177/24725552211023211

High-Throughput Affinity Selection Mass Spectrometry Using SAMDI-MS to Identify Small-Molecule Binders of the Human Rhinovirus 3C Protease


More Sars Cov 2 3cl sentence examples
10.1002/cmdc.202100576

A patent review on SARS coronavirus main protease (3CLpro) inhibitors.


More Sars Cov 2 3cl sentence examples
10.3389/fphar.2021.619373

Phytoconstituents, In Vitro Anti-Infective Activity of Buddleja indica Lam., and In Silico Evaluation of its SARS-CoV-2 Inhibitory Potential


More Sars Cov 2 3cl sentence examples
10.21203/RS.3.RS-314304/V2

An Integrated Method For Optimized Identification of Effective Natural Inhibitors Against SARS-CoV-2 3CLpro


More Sars Cov 2 3cl sentence examples
10.1016/j.molstruc.2021.130506

Screening of cryptogamic secondary metabolites as putative inhibitors of SARS-CoV-2 main protease and ribosomal binding domain of spike glycoprotein by molecular docking and molecular dynamics approaches


More Sars Cov 2 3cl sentence examples
10.1016/j.compbiomed.2021.104671

Structure-based virtual screening suggests inhibitors of 3-Chymotrypsin-Like Protease of SARS-CoV-2 from Vernonia amygdalina and Occinum gratissimum


More Sars Cov 2 3cl sentence examples
10.1007/978-3-030-75275-0_99

In Silico Analysis of Scopoletin Interaction with Potential SARS-CoV-2 Target


More Sars Cov 2 3cl sentence examples
10.1021/acsomega.1c01797

Inhibition of the 3CL Protease and SARS-CoV-2 Replication by Dalcetrapib


More Sars Cov 2 3cl sentence examples
10.19193/0393-6384_2021_4_307

Study on mechanism of fangyi qingfei decoction against Covid-19 associated lung and kidney injury based on network pharmacology and molecular docking


More Sars Cov 2 3cl sentence examples
10.1016/j.molliq.2020.114999

Computational study on peptidomimetic inhibitors against SARS-CoV-2 main protease



Identification of a novel inhibitor of SARS-CoV-2 3CL-PRO through virtual screening and molecular dynamics simulation



The mechanism and active compounds of semen armeniacae amarum treating coronavirus disease 2019 based on network pharmacology and molecular docking


More Sars Cov 2 3cl sentence examples
10.26434/CHEMRXIV.14781567.V1

Structure-Guided Design of Potent Inhibitors of SARS-CoV-2 3CL Protease: Structural, Biochemical, and Cell-Based Studies.


More Sars Cov 2 3cl sentence examples
10.1016/j.ijbiomac.2021.04.129

Identification of Vitamin K3 and its analogues as covalent inhibitors of SARS-CoV-2 3CLpro



Identification of the anti-COVID-19 mechanism of action of Han-Shi Blocking Lung using network pharmacology-integrated molecular docking


More Sars Cov 2 3cl sentence examples
10.1016/j.bbadva.2021.100016

Asymmetric dynamics of dimeric SARS-CoV-2 and SARS-CoV main proteases in an apo form: Molecular dynamics study on fluctuations of active site, catalytic dyad, and hydration water


More Sars Cov 2 3cl sentence examples
10.1016/j.compbiomed.2021.104538

Interaction of selected terpenoids with two SARS-CoV-2 key therapeutic targets: An in silico study through molecular docking and dynamics simulations


More Sars Cov 2 3cl sentence examples
10.1021/acs.jmedchem.1c00616

Peptidomimetic α-Acyloxymethylketone Warheads with Six-Membered Lactam P1 Glutamine Mimic: SARS-CoV-2 3CL Protease Inhibition, Coronavirus Antiviral Activity, and in Vitro Biological Stability



Computational simulations on the binding and reactivity of a nitrile inhibitor of the SARS-CoV-2 main protease.


More Sars Cov 2 3cl sentence examples
10.26434/chemrxiv.13087742.v2

Design, Synthesis and Biological Evaluation of Novel SARS-CoV-2 3CLpro Covalent Inhibitors


More Sars Cov 2 3cl sentence examples
10.1038/s41392-021-00628-x

Bardoxolone and bardoxolone methyl, two Nrf2 activators in clinical trials, inhibit SARS-CoV-2 replication and its 3C-like protease


More Sars Cov 2 3cl sentence examples
10.1107/S2052252521001159

Crystallographic models of SARS-CoV-2 3CLpro: in-depth assessment of structure quality and validation


More Sars Cov 2 3cl sentence examples
10.1016/j.ijbiomac.2021.02.012

Epigallocatechin-3-gallate, an active ingredient of Traditional Chinese Medicines, inhibits the 3CLpro activity of SARS-CoV-2


More Sars Cov 2 3cl sentence examples
10.1007/s11030-021-10330-3

Computational investigation of drug bank compounds against 3C-like protease (3CLpro) of SARS-CoV-2 using deep learning and molecular dynamics simulation


More Sars Cov 2 3cl sentence examples
10.2174/0929867328666210726094955

Natural Products with tandem Anti-inflammatory, Immunomodulatory and Anti-SARS-CoV/2 effects: A Drug Discovery Perspective against SARS-CoV-2.


More Sars Cov 2 3cl sentence examples
10.1016/j.virol.2021.01.010

Detecting SARS-CoV-2 3CLpro expression and activity using a polyclonal antiserum and a luciferase-based biosensor


More Sars Cov 2 3cl sentence examples
10.1016/j.bbrc.2021.02.016

EGCG, a green tea polyphenol, inhibits human coronavirus replication in vitro



Potential In Vitro Inhibition of Selected Plant Extracts against SARS-CoV-2 Chymotripsin-Like Protease (3CLPro) Activity


More Sars Cov 2 3cl sentence examples
10.1021/acs.jmedchem.1c00598

Structure-Based Optimization of ML300-Derived, Noncovalent Inhibitors Targeting the Severe Acute Respiratory Syndrome Coronavirus 3CL Protease (SARS-CoV-2 3CLpro)


More Sars Cov 2 3cl sentence examples
10.1016/j.coviro.2021.04.006

Considerations for the discovery and development of 3-chymotrypsin-like cysteine protease inhibitors targeting SARS-CoV-2 infection


More Sars Cov 2 3cl sentence examples
10.1080/07391102.2021.1927845

Proposition of a new allosteric binding site for potential SARS-CoV-2 3CL protease inhibitors by utilizing molecular dynamics simulations and ensemble docking


More Sars Cov 2 3cl sentence examples
10.1101/2021.08.29.458083

Allosteric regulation of 3CL protease of SARS-CoV-2 and SARS-CoV observed in the crystal structure ensemble


More Sars Cov 2 3cl sentence examples
10.1080/07391102.2021.1871863

Flavonol morin targets host ACE2, IMP-α, PARP-1 and viral proteins of SARS-CoV-2, SARS-CoV and MERS-CoV critical for infection and survival: a computational analysis



All-Trans Retinoic Acid Exhibits Antiviral Effect against SARS-CoV-2 by Inhibiting 3CLpro Activity


More Sars Cov 2 3cl sentence examples
10.3389/fmolb.2021.661424

An Integrated Computational and Experimental Approach to Identifying Inhibitors for SARS-CoV-2 3CL Protease


More Sars Cov 2 3cl sentence examples
10.2174/1573406417666210806154129

Structural bioinformatics used to predict the protein targets of remdesivir and flavones in SARS-CoV-2 infection.



Tomatidine and Patchouli Alcohol as Inhibitors of SARS-CoV-2 Enzymes (3CLpro, PLpro and NSP15) by Molecular Docking and Molecular Dynamics Simulations



Development of a Cell-Based Luciferase Complementation Assay for Identification of SARS-CoV-2 3CLpro Inhibitors


More Sars Cov 2 3cl sentence examples
10.1016/j.bmcl.2021.128263

A head-to-head comparison of the inhibitory activities of 15 peptidomimetic SARS-CoV-2 3CLpro inhibitors


More Sars Cov 2 3cl sentence examples
10.1016/j.jbi.2021.103821

Machine learning enabled identification of potential SARS-CoV-2 3CLpro inhibitors based on fixed molecular fingerprints and Graph-CNN neural representations☆


More Sars Cov 2 3cl sentence examples
10.1016/j.bbrc.2021.03.096

ALG-097111, a potent and selective SARS-CoV-2 3-chymotrypsin-like cysteine protease inhibitor exhibits in vivo efficacy in a Syrian Hamster model


More Sars Cov 2 3cl sentence examples
10.3389/fphar.2021.720018

Ugonin J Acts as a SARS-CoV-2 3C-like Protease Inhibitor and Exhibits Anti-inflammatory Properties


More Sars Cov 2 3cl sentence examples
10.1016/j.antiviral.2021.105020

Dual inhibition of SARS-CoV-2 and human rhinovirus with protease inhibitors in clinical development


More Sars Cov 2 3cl sentence examples
10.3390/molecules26195782

Chloropyridinyl Esters of Nonsteroidal Anti-Inflammatory Agents and Related Derivatives as Potent SARS-CoV-2 3CL Protease Inhibitors


More Sars Cov 2 3cl sentence examples
10.3390/biomedicines9040375

Rutin Is a Low Micromolar Inhibitor of SARS-CoV-2 Main Protease 3CLpro: Implications for Drug Design of Quercetin Analogs


More Sars Cov 2 3cl sentence examples
10.1021/acs.jcim.1c00994

Synergistic Effects of Natural Compounds Toward Inhibition of SARS-CoV-2 3CL Protease.


More Sars Cov 2 3cl sentence examples
10.2174/1389201022666210604150041

Identification of novel drug candidates for the inhibition of catalytic cleavage activity of coronavirus 3CL-like protease enzyme.



Toward the Identification of Potential α-Ketoamide Covalent Inhibitors for SARS-CoV-2 Main Protease: Fragment-Based Drug Design and MM-PBSA Calculations


More Sars Cov 2 3cl sentence examples
10.1101/2021.03.19.435806

Combined computational and cellular screening identifies synergistic inhibition of SARS-CoV-2 by lenvatinib and remdesivir


More Sars Cov 2 3cl sentence examples
10.1016/j.fitote.2021.104909

Discovery of naturally occurring inhibitors against SARS-CoV-2 3CLpro from Ginkgo biloba leaves via large-scale screening


More Sars Cov 2 3cl sentence examples
10.1016/j.ijbiomac.2021.07.167

Flavonoids in Ampelopsis grossedentata as covalent inhibitors of SARS-CoV-2 3CLpro: Inhibition potentials, covalent binding sites and inhibitory mechanisms


More Sars Cov 2 3cl sentence examples
10.1016/j.chemolab.2021.104421

Anti-COVID-19 activity of some benzofused 1,2,3-triazolesulfonamide hybrids using in silico and in vitro analyses



Targeting the SARS-CoV-2 3CLpro and NO/cGMP/PDE5 pathway in COVID-19: a commentary on PDE5 inhibitors



Can natural products stop the SARS-CoV-2 virus? A docking and molecular dynamics study of a natural product database


More Sars Cov 2 3cl sentence examples
10.1021/acscatal.0c05522

Multiscale Simulations of SARS-CoV-2 3CL Protease Inhibition with Aldehyde Derivatives. Role of Protein and Inhibitor Conformational Changes in the Reaction Mechanism


More Sars Cov 2 3cl sentence examples
10.1080/14756366.2020.1850710

Repurposing existing drugs: identification of SARS-CoV-2 3C-like protease inhibitors


More Sars Cov 2 3cl sentence examples
10.21203/RS.3.RS-383586/V1

Elucidation of the inhibitory activity of plant-derived SARS-CoV inhibitors and their potential as SARS-CoV-2 inhibitors


More Sars Cov 2 3cl sentence examples
10.1080/07391102.2021.1938234

Elucidation of the inhibitory activity of plant-derived SARS-CoV inhibitors and their potential as SARS-CoV-2 inhibitors.


More Sars Cov 2 3cl sentence examples
10.1016/j.jmb.2021.167324

Allosteric regulation of 3CL protease of SARS-CoV-2 and SARS-CoV observed in the crystal structure ensemble


More Sars Cov 2 3cl sentence examples
10.1080/1062936X.2021.1914721

Robust classification-based molecular modelling of diverse chemical entities as potential SARS-CoV-2 3CLpro inhibitors: theoretical justification in light of experimental evidences


More Sars Cov 2 3cl sentence examples
10.1016/j.bbrc.2020.12.106

The inhibitory effects of PGG and EGCG against the SARS-CoV-2 3C-like protease



The Repurposed Drugs Suramin and Quinacrine Cooperatively Inhibit SARS-CoV-2 3CLpro In Vitro


More Sars Cov 2 3cl sentence examples
10.1021/acsptsci.0c00216

Identification of Inhibitors of SARS-CoV-2 3CL-Pro Enzymatic Activity Using a Small Molecule in Vitro Repurposing Screen



Study on the mechanism of active components of Liupao tea on 3CLpro based on HPLC-DAD fingerprint and molecular docking technique.


More Sars Cov 2 3cl sentence examples
10.1002/anie.202110027

Inhibition Mechanism of SARS-CoV-2 Main Protease with Ketone-Based Inhibitors Unveiled by Multiscale Simulations. Insights for Improved Designs.


Learn more from Sars Cov 2 3cl

Keywords related to 3cl


Sars Cov 2 3cl
Encyclopedia