Jonathan B Baell

KNIME Workflow to Assess PAINS Filters in SMARTS Format. Comparison of RDKit and Indigo Cheminformatics Libraries

Rajarshi Guha, Simon Saubern, Jonathan B Baell, 2011, Molecular informatics.

Seven Year Itch: Pan-Assay Interference Compounds (PAINS) in 2017—Utility and Limitations

J Willem M Nissink, Jonathan B Baell, J. Baell, 2017, ACS chemical biology.

Assay interference and off-target liabilities of reported histone acetyltransferase inhibitors

Nghi Nguyen, Michael A Walters, Jayme L Dahlin, 2017, Nature Communications.

Feeling Nature's PAINS: Natural Products, Natural Product Drugs, and Pan Assay Interference Compounds (PAINS).

Jonathan B Baell, J. Baell, 2016, Journal of natural products.

Screening-based translation of public research encounters painful problems.

Jonathan B Baell, J. Baell, 2015, ACS medicinal chemistry letters.

De-novo designed library of benzoylureas as inhibitors of BCL-XL: synthesis, structural and biochemical characterization.

Brian J Smith, Nathan Toovey, Jonathan B Baell, 2014, Journal of medicinal chemistry.

An Efficient High-Throughput Screening Method for MYST Family Acetyltransferases, a New Class of Epigenetic Drug Targets

George Nikolakopoulos, Olan Dolezal, Thomas S Peat, 2011, Journal of biomolecular screening.

Promiscuous 2-aminothiazoles (PrATs): a frequent hitting scaffold.

J Willem M Nissink, Jonathan B Baell, Martin J Scanlon, 2015, Journal of medicinal chemistry.