Computational and Experimental Approaches Identify Beta-Blockers as Potential SARS-CoV-2 Spike Inhibitors

Author:

Puhl Ana C.1ORCID,Mottin Melina23,Sacramento Carolina Q.45,Tavella Tatyana Almeida6,Dias Gabriel Gonçalves2,Fintelman-Rodrigues Natalia45,Temerozo Jairo R.78,Dias Suelen S. G.4,Ramos Paulo Ricardo Pimenta da Silva2,Merten Eric M.9,Pearce Kenneth H.910,Costa Fabio Trindade Maranhão6,Premkumar Lakshmanane11,Souza Thiago Moreno L.45,Andrade Carolina Horta2ORCID,Ekins Sean1ORCID

Affiliation:

1. Collaborations Pharmaceuticals, Inc., 840 Main Campus Drive, Lab 3510, Raleigh, North Carolina 27606, United States

2. LabMol - Laboratory of Molecular Modeling and Drug Design, Faculdade de Farmácia, Universidade Federal de Goiás, Goiânia 74605-170, GO, Brazil

3. Pathogen-Host Interface Laboratory, Department of Cell Biology, University of Brasilia, Brasilia 70910-900, Brazil

4. Laboratory of Immunopharmacology, Oswaldo Cruz Institute─Fiocruz, Rio de Janeiro 21040-360, RJ, Brazil

5. Center of Technological Development in Health (CDTS)/National Institute of Science and Technology for Innovation on Neglected Population Diseases (INCT-IDPN), Rio de Janeiro 21040-900, RJ, Brazil

6. Laboratory of Tropical Diseases─Prof. Dr. Luiz Jacinto da Silva, Department of Genetics, Evolution, Microbiology and Immunology, University of Campinas-UNICAMP, Campinas 13083-970, SP, Brazil

7. Laboratory on Thymus Research, Oswaldo Cruz Institute─Fiocruz, Rio de Janeiro 21040-900, RJ, Brazil

8. National Institute for Science and Technology on Neuroimmunomodulation (INCT/NIM), Oswaldo Cruz Institute─Fiocruz, Rio de Janeiro 21040-360, RJ, Brazil

9. Center for Integrative Chemical Biology and Drug Discovery, Chemical Biology and Medicinal Chemistry, Eshelman School of Pharmacy, University of North Carolina, Chapel Hill, North Carolina 27599, United States

10. UNC Lineberger Comprehensive Cancer Center, Chapel Hill, North Carolina 27599, United States

11. Department of Microbiology and Immunology, University of North Carolina School of Medicine, Chapel Hill, North Carolina 27599, United States

Funder

North Carolina General Assembly

Funda??o de Amparo ? Pesquisa do Estado de Goi?s

National Center for Complementary and Integrative Health

Conselho Nacional de Desenvolvimento Cient?fico e Tecnol?gico

Funda??o de Amparo ? Pesquisa do Estado de S?o Paulo

National Institute of General Medical Sciences

Coordena??o de Aperfei?oamento de Pessoal de N?vel Superior

Publisher

American Chemical Society (ACS)

Subject

General Chemical Engineering,General Chemistry

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