Publications by authors named "Ya-Qi Xiao"

SARS-CoV-2 continues to mutate, spread, and impact public health and daily life. The main protease (M) is essential for the replication and maturation of SARS-CoV-2, making it an ideal target for anti-coronaviral drug discovery and development due to its high conservation and lack of homologous proteases in humans. Herein, we designed and synthesized a series of dithiocarbamate derivatives as potent SARS-CoV-2 M inhibitors.

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The COVID-19 pandemic continues to pose a threat to global health, and sounds the alarm for research & development of effective anti-coronavirus drugs, which are crucial for the patients and urgently needed for the current epidemic and future crisis. The main protease (M) stands as an essential enzyme in the maturation process of SARS-CoV-2, playing an irreplaceable role in regulating viral RNA replication and transcription. It has emerged as an ideal target for developing antiviral agents against SARS-CoV-2 due to its high conservation and the absence of homologous proteases in the human body.

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Article Synopsis
  • * The synthesized compounds showed varying levels of effectiveness against wild-type HIV-1, with some exhibiting strong potency and selectivity as reverse transcriptase inhibitors, especially compound 4d, which was particularly effective against both wild-type and several mutant strains of HIV-1.
  • * Additional analyses included assessing the structure-activity relationships of the compounds, performing molecular modeling to investigate how DPAPYs bind to HIV-1 reverse transcriptase, and predicting their
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