In Silico Evaluation of the Effectivity of Approved Protease Inhibitors against the Main Protease of the Novel SARS-CoV-2 Virus.

Eleftheriou, Phaedra; Amanatidou, Dionysia; Petrou, Anthi; Geronikaki, Athina

Eleftheriou, Phaedra; Amanatidou, Dionysia; Petrou, Anthi; Geronikaki, Athina.

Affiliation

Eleftheriou P; Department of Biomedical Sciences, School of Health, International Hellenic University, 57400 Thessaloniki, Greece.
Amanatidou D; Department of Biomedical Sciences, School of Health, International Hellenic University, 57400 Thessaloniki, Greece.
Petrou A; Department of Pharmaceutical Chemistry, School of Pharmacy, Aristotle University of Thessaloniki, 54124 Thessaloniki, Greece.
Geronikaki A; Department of Pharmaceutical Chemistry, School of Pharmacy, Aristotle University of Thessaloniki, 54124 Thessaloniki, Greece.

Molecules ; 25(11)2020 May 29.

Article in En | MEDLINE | ID: mdl-32485894

Subject(s)

Anticoagulants/chemistry; Antiviral Agents/chemistry; Betacoronavirus/drug effects; Dipeptidyl-Peptidase IV Inhibitors/chemistry; Protease Inhibitors/chemistry; Viral Nonstructural Proteins/antagonists & inhibitors; Amino Acid Sequence; Anticoagulants/pharmacology; Antiviral Agents/pharmacology; Betacoronavirus/chemistry; Betacoronavirus/enzymology; Betacoronavirus/genetics; Binding Sites; COVID-19; Coronavirus 3C Proteases; Coronavirus Infections/drug therapy; Cysteine Endopeptidases/chemistry; Cysteine Endopeptidases/genetics; Cysteine Endopeptidases/metabolism; Dipeptidyl Peptidase 4/chemistry; Dipeptidyl Peptidase 4/genetics; Dipeptidyl Peptidase 4/metabolism; Dipeptidyl-Peptidase IV Inhibitors/pharmacology; Factor Xa/chemistry; Factor Xa/genetics; Factor Xa/metabolism; Hepacivirus/chemistry; Hepacivirus/enzymology; Hepacivirus/genetics; Humans; Molecular Docking Simulation; Pandemics; Pneumonia, Viral/drug therapy; Protease Inhibitors/pharmacology; Protein Binding; Protein Conformation; Protein Interaction Domains and Motifs; SARS-CoV-2; Sequence Alignment; Structural Homology, Protein; Substrate Specificity; Thermodynamics; Thrombin/antagonists & inhibitors; Thrombin/chemistry; Thrombin/genetics; Thrombin/metabolism; Viral Nonstructural Proteins/chemistry; Viral Nonstructural Proteins/genetics; Viral Nonstructural Proteins/metabolism

Key words

DPP-4 inhibitors; HCV protease inhibitors; SARS-CoV-2; a-thrombin inhibitors; coronavirus; docking; protease inhibitors

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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Antiviral Agents / Protease Inhibitors / Viral Nonstructural Proteins / Dipeptidyl-Peptidase IV Inhibitors / Betacoronavirus / Anticoagulants Type of study: Prognostic_studies Language: En Journal: Molecules Journal subject: BIOLOGIA Year: 2020 Type: Article Affiliation country: Greece

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