Title : Discovery of novel TMPRSS2 inhibitors for COVID-19 using in silico fragment-based drug design, molecular docking, molecular dynamics, and quantum mechanics studies.

Pub. Date : 2022

PMID : 35128036






1 Functional Relationships(s)
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1 Because the androgen-responsive serine protease TMPRSS2 is involved in cleaving the SARS-CoV-2 spike protein allowing the virus to enter the cell, therefore, direct TMPRSS2 inhibition will inhibit virus activation and disease progression which make it an important target for drug discovery. Serine surface glycoprotein Severe acute respiratory syndrome coronavirus 2