New substructure filters for removal of pan assay interference compounds (PAINS) from screening libraries and for their exclusion in bioassays JB Baell, GA Holloway Journal of medicinal chemistry 53 (7), 2719-2740, 2010 | 4017 | 2010 |
Chemistry: Chemical con artists foil drug discovery J Baell, MA Walters Nature 513 (7519), 481-483, 2014 | 1193 | 2014 |
The promise and peril of chemical probes CH Arrowsmith, JE Audia, C Austin, J Baell, J Bennett, J Blagg, C Bountra, ... Nature chemical biology 11 (8), 536-541, 2015 | 880 | 2015 |
Seven Year Itch: Pan-Assay Interference Compounds (PAINS) in 2017 Utility and Limitations JB Baell, JWM Nissink ACS chemical biology 13 (1), 36-44, 2018 | 615 | 2018 |
Feeling nature’s PAINS: natural products, natural product drugs, and pan assay interference compounds (PAINS) JB Baell Journal of natural products 79 (3), 616-628, 2016 | 544 | 2016 |
Structural basis for modulation of a G-protein-coupled receptor by allosteric drugs RO Dror, HF Green, C Valant, DW Borhani, JR Valcourt, AC Pan, ... Nature 503 (7475), 295-299, 2013 | 460 | 2013 |
Structure-guided design of a selective BCL-XL inhibitor G Lessene, PE Czabotar, BE Sleebs, K Zobel, KN Lowes, JM Adams, ... Nature chemical biology 9 (6), 390-397, 2013 | 452 | 2013 |
FAF-Drugs3: a web server for compound property calculation and chemical library design D Lagorce, O Sperandio, JB Baell, MA Miteva, BO Villoutreix Nucleic acids research 43 (W1), W200-W207, 2015 | 315 | 2015 |
Inhibitors of histone acetyltransferases KAT6A/B induce senescence and arrest tumour growth JB Baell, DJ Leaver, SJ Hermans, GL Kelly, MS Brennan, NL Downer, ... Nature 560 (7717), 253-257, 2018 | 247 | 2018 |
Prospects for targeting the Bcl-2 family of proteins to develop novel cytotoxic drugs JB Baell, DCS Huang Biochemical pharmacology 64 (5-6), 851-863, 2002 | 243 | 2002 |
Observations on screening-based research and some concerning trends in the literature JB Baell Future medicinal chemistry 2 (10), 1529-1546, 2010 | 197 | 2010 |
HBO1 is required for the maintenance of leukaemia stem cells L MacPherson, J Anokye, MM Yeung, EYN Lam, YC Chan, CF Weng, ... Nature 577 (7789), 266-270, 2020 | 148 | 2020 |
KNIME workflow to assess PAINS filters in SMARTS format. Comparison of RDKit and Indigo cheminformatics libraries S Saubern, R Guha, JB Baell Molecular informatics 30 (10), 847-850, 2011 | 145 | 2011 |
Low cost whole-organism screening of compounds for anthelmintic activity S Preston, A Jabbar, C Nowell, A Joachim, B Ruttkowski, J Baell, ... International journal for parasitology 45 (5), 333-343, 2015 | 126 | 2015 |
Stimulus-cleavable chemistry in the field of controlled drug delivery Y Xue, H Bai, B Peng, B Fang, J Baell, L Li, W Huang, NH Voelcker Chemical Society Reviews 50 (8), 4872-4931, 2021 | 123 | 2021 |
Assay interference and off-target liabilities of reported histone acetyltransferase inhibitors JL Dahlin, KM Nelson, JM Strasser, D Barsyte-Lovejoy, MM Szewczyk, ... Nature communications 8 (1), 1-14, 2017 | 112 | 2017 |
The FAF-Drugs2 server: a multistep engine to prepare electronic chemical compound collections D Lagorce, J Maupetit, J Baell, O Sperandio, P Tufféry, MA Miteva, ... Bioinformatics 27 (14), 2018-2020, 2011 | 109 | 2011 |
Drug repurposing: Misconceptions, challenges, and opportunities for academic researchers CG Begley, M Ashton, J Baell, M Bettess, MP Brown, B Carter, ... Science Translational Medicine 13 (612), eabd5524, 2021 | 107 | 2021 |
Singlet molecular oxygen regulates vascular tone and blood pressure in inflammation CP Stanley, GJ Maghzal, A Ayer, J Talib, AM Giltrap, S Shengule, ... Nature 566 (7745), 548-552, 2019 | 107 | 2019 |
Defining the mechanisms by which the reactive oxygen species by-product, 4-hydroxynonenal, affects human sperm cell function MA Baker, A Weinberg, L Hetherington, AI Villaverde, T Velkov, J Baell, ... Biology of Reproduction 92 (4), 108, 1-10, 2015 | 103 | 2015 |