Identification of 3-chymotrypsin like protease (3CLPro) inhibitors as potential anti-SARS-CoV-2 agents.

Mody, Vicky; Ho, Joanna; Wills, Savannah; Mawri, Ahmed; Lawson, Latasha; Ebert, Maximilian C C J C; Fortin, Guillaume M; Rayalam, Srujana; Taval, Shashidharamurthy

Mody, Vicky; Ho, Joanna; Wills, Savannah; Mawri, Ahmed; Lawson, Latasha; Ebert, Maximilian C C J C; Fortin, Guillaume M; Rayalam, Srujana; Taval, Shashidharamurthy.

Afiliação

Mody V; Department of Pharmaceutical Sciences, School of Pharmacy, Philadelphia College of Osteopathic Medicine - Georgia Campus, Suwanee, GA, USA.
Ho J; Department of Pharmaceutical Sciences, School of Pharmacy, Philadelphia College of Osteopathic Medicine - Georgia Campus, Suwanee, GA, USA.
Wills S; Department of Pharmaceutical Sciences, School of Pharmacy, Philadelphia College of Osteopathic Medicine - Georgia Campus, Suwanee, GA, USA.
Mawri A; Department of Pharmaceutical Sciences, School of Pharmacy, Philadelphia College of Osteopathic Medicine - Georgia Campus, Suwanee, GA, USA.
Lawson L; Department of Pharmaceutical Sciences, School of Pharmacy, Philadelphia College of Osteopathic Medicine - Georgia Campus, Suwanee, GA, USA.
Ebert MCCJC; Chemical Computing Group, 910-1010 Sherbrooke W, Montreal, QC, H3A 2R7, Canada.
Fortin GM; Chemical Computing Group, 910-1010 Sherbrooke W, Montreal, QC, H3A 2R7, Canada.
Rayalam S; Department of Pharmaceutical Sciences, School of Pharmacy, Philadelphia College of Osteopathic Medicine - Georgia Campus, Suwanee, GA, USA.
Taval S; Department of Pharmaceutical Sciences, School of Pharmacy, Philadelphia College of Osteopathic Medicine - Georgia Campus, Suwanee, GA, USA. rangaiahsh@pcom.edu.

Commun Biol ; 4(1): 93, 2021 01 20.

Article em En | MEDLINE | ID: mdl-33473151

Assuntos

Antivirais/farmacologia; Tratamento Farmacológico da COVID-19; Proteases 3C de Coronavírus/antagonistas & inibidores; Inibidores de Cisteína Proteinase/farmacologia; Descoberta de Drogas; SARS-CoV-2/efeitos dos fármacos; Replicação Viral/efeitos dos fármacos; Antivirais/química; COVID-19/virologia; Proteases 3C de Coronavírus/química; Proteases 3C de Coronavírus/metabolismo; Inibidores de Cisteína Proteinase/química; Humanos; Ligantes; Simulação de Acoplamento Molecular; Simulação de Dinâmica Molecular; Ligação Proteica; Conformação Proteica; SARS-CoV-2/enzimologia; Relação Estrutura-Atividade

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Texto completo: 1 Base de dados: MEDLINE Assunto principal: Antivirais / Replicação Viral / Inibidores de Cisteína Proteinase / Descoberta de Drogas / Proteases 3C de Coronavírus / SARS-CoV-2 / Tratamento Farmacológico da COVID-19 Idioma: En Ano de publicação: 2021 Tipo de documento: Article

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