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Updated: Feb 23, 2026

Pharmacophore Modeling for Targets with Extensive Ligand Libraries: A Case Study on SARS-CoV-2 Mpro
05:50

Pharmacophore Modeling for Targets with Extensive Ligand Libraries: A Case Study on SARS-CoV-2 Mpro

Published on: September 26, 2025

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SARS-CoV-2を標的にするベンゾチアゾールベースの推定共振性阻害剤の電子性弾頭の関与と構造-活性関係 メインプロテアゼ

Sofia Kanwal1, Anees Saeed1, Ayesha Tahir1

  • 1Department of Chemistry, COMSATS University Islamabad, Abbottabad Campus, 22060 Abbottabad, Pakistan.

Bioorganic chemistry
|February 21, 2026
PubMed
まとめ

新しいベンゾチアゾール誘導体は,SARS-CoV-2 メインプロテアゼ (Mpro) 阻害剤として強力な可能性を秘めている. 化合物35は,高い効能と選択性を示し,安全性と構造の安定性に優れています.

キーワード:
ベンゾチアゾール Benzothiazole ベンゾチアゾールコーヴェラントドッキングメインプロテアゼ メインプロテアゼ推定的共振性阻害剤は,共振性阻害剤とされている.SARS-CoV-2は,SARS-CoV-2に感染している.

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