High-Throughput Hit Identification with Acoustic Ejection Mass Spectrometry

SLAS TECHNOLOGY, Journal Year: 2025, Volume and Issue: unknown, P. 100245 - 100245

Published: Jan. 1, 2025

Language: Английский

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The Druggable Transcriptome Project: From Chemical Probes to Precision Medicines

Biochemistry, Journal Year: 2025, Volume and Issue: unknown

Published: March 25, 2025

RNA presents abundant opportunities as a drug target, offering significant potential for small molecule medicine development. The transcriptome, comprising both coding and noncoding RNAs, is rich area therapeutic innovation, yet challenges persist in targeting with molecules. structure can be predicted or without experimental data, but discrepancies the actual biological impede progress. Prioritizing targets supported by genetic evolutionary evidence enhances success. Further, molecules must demonstrate binding to cells, not solely vitro, validate target compound. Effective binders modulate functional sites that influence biology, nonfunctional requires recruiting effector mechanisms, example degradation, achieve outcomes. Addressing these critical unlocking RNA's vast medicines, strategic framework proposed navigate this promising field, focus on human RNAs.

Language: Английский

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Virtual Screening and Fragment Growth Strategy for Developing Near-Infrared Fluorescent Probes to Detect Aβ in Alzheimer’s Disease Model

European Journal of Medicinal Chemistry, Journal Year: 2025, Volume and Issue: unknown, P. 117695 - 117695

Published: April 1, 2025

Language: Английский

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Investigating Active Site Binding of Ligands to High and Low Activity Carbonic Anhydrase Enzymes Using Native Mass Spectrometry

Journal of Medicinal Chemistry, Journal Year: 2024, Volume and Issue: 67(17), P. 15862 - 15872

Published: Aug. 20, 2024

Carbonic anhydrases (CAs) are a family of enzymes that play an important pH regulatory role in health and disease. While different CA isozymes have high degree structural similarity, they variable enzymatic activity, with III being the least active having less than 1% activity II, most active. Furthermore, ligand binding studies for limited, resulting lack chemical probes impedes understanding this isozyme comparison to other members where abundant. Therefore, we employed native mass spectrometry (nMS), also known as intact spectrometry, assess II discovered two novel compounds first time display strong III. We present new data visualization quantification tool developed spectra intuitive stacked heat map representation rapidly interpreting results ligand-protein from nMS screening.

Language: Английский

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Emerging opportunities for intact and native protein analysis using chemical proteomics

Analytica Chimica Acta, Journal Year: 2024, Volume and Issue: 1338, P. 343551 - 343551

Published: Dec. 15, 2024

Language: Английский

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