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Mem. Inst. Oswaldo Cruz ; 115: e200179, 2020. graf
Article in English | LILACS, Sec. Est. Saúde SP | ID: biblio-1135266

ABSTRACT

Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) infection depends on viral polyprotein processing, catalysed by the main proteinase (Mpro). The solution of the SARS-CoV-2 Mpro structure allowed the investigation of potential inhibitors. This work aims to provide first evidences of the applicability of commercially approved drugs to treat coronavirus disease-19 (COVID-19). We screened 4,334 compounds to found potential inhibitors of SARS-CoV-2 replication using an in silico approach. Our results evidenced the potential use of coagulation modifiers in COVID-19 treatment due to the structural similarity of SARS-CoV-2 Mpro and human coagulation factors thrombin and Factor Xa. Further in vitro and in vivo analysis are needed to corroborate these results.


Subject(s)
Humans , Protease Inhibitors/chemistry , Viral Nonstructural Proteins/antagonists & inhibitors , Betacoronavirus , Structure-Activity Relationship , Computer Simulation , Cysteine Endopeptidases , Coronavirus Infections/drug therapy , Coronavirus 3C Proteases , SARS-CoV-2 , COVID-19/drug therapy
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