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Frontiers in Pharmacology|August 23, 2021
Novel Mechanism for an Old Drug: Phenazopyridine is a Kinase Inhibitor Affecting Autophagy and Cellular DifferentiationOlivier Preynat-Seauve, Evelyne Bao-Vi Nguyen, Yvonne Westermaier, et al.Journal of Chemical Information and Modeling|December 28, 2022
High-Throughput Prediction of the Impact of Genetic Variability on Drug Sensitivity and Resistance Patterns for Clinically Relevant Epidermal Growth Factor Receptor Mutations from Atomistic SimulationsAristarc Suriñach, Adam Hospital, Yvonne Westermaier, et al.British Journal of Pharmacology|April 20, 2011
NADPH oxidase (NOX) isoforms are inhibited by celastrol with a dual mode of actionVincent Jaquet, Julien Marcoux, Eric Forest, et al.Biomedicine & Pharmacotherapy = Biomedecine & Pharmacotherapie|December 18, 2024
Identification of the atypical antipsychotic Asenapine as a direct survivin inhibitor with anticancer properties and sensitizing effects to conventional therapiesCristina Benítez-García, David Martínez-García, Martin Kotev, et al.ACS Chemical Biology|July 3, 2024
Confounding Factors in Targeted Degradation of Short-Lived ProteinsVesna Vetma, Laura Casares Perez, Ján Eliaš, et al.Nature Communications|April 14, 2025
Drugit: crowd-sourcing molecular design of non-peptidic VHL bindersThomas Scott, Christian Alan Paul Smethurst, Yvonne Westermaier, et al.Journal of Chemical Information and Modeling|January 21, 2026
CACHE Challenge #3: Targeting the Nsp3 Macrodomain of SARS-CoV-2Oleksandra Herasymenko, Madhushika Silva, Galen J Correy, et al.Journal of Chemical Information and Modeling|June 20, 2025
CACHE Challenge #2: Targeting the RNA Site of the SARS-CoV-2 Helicase Nsp13Oleksandra Herasymenko, Madhushika Silva, Abd Al-Aziz A Abu-Saleh, et al.Pageof 2