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Big Data in Drug Discovery.
Brown N, Cambruzzi J, Cox PJ, Davies M, Dunbar J, Plumbley D, Sellwood MA, Sim A, Williams-Jones BI, Zwierzyna M, Sheppard DW. Brown N, et al. Prog Med Chem. 2018;57(1):277-356. doi: 10.1016/bs.pmch.2017.12.003. Epub 2018 Feb 24. Prog Med Chem. 2018. PMID: 29680150 Review.
Special Issue: Cheminformatics in Drug Discovery.
Bender A, Brown N. Bender A, et al. Among authors: brown n. ChemMedChem. 2018 Mar 20;13(6):467-469. doi: 10.1002/cmdc.201800123. ChemMedChem. 2018. PMID: 29575670
Artificial intelligence in drug discovery.
Sellwood MA, Ahmed M, Segler MH, Brown N. Sellwood MA, et al. Among authors: brown n. Future Med Chem. 2018 Sep 1;10(17):2025-2028. doi: 10.4155/fmc-2018-0212. Epub 2018 Aug 13. Future Med Chem. 2018. PMID: 30101607 No abstract available.
Artificial intelligence in chemistry and drug design.
Brown N, Ertl P, Lewis R, Luksch T, Reker D, Schneider N. Brown N, et al. J Comput Aided Mol Des. 2020 Jul;34(7):709-715. doi: 10.1007/s10822-020-00317-x. J Comput Aided Mol Des. 2020. PMID: 32468207 Review. No abstract available.
Aurora isoform selectivity: design and synthesis of imidazo[4,5-b]pyridine derivatives as highly selective inhibitors of Aurora-A kinase in cells.
Bavetsias V, Faisal A, Crumpler S, Brown N, Kosmopoulou M, Joshi A, Atrash B, Pérez-Fuertes Y, Schmitt JA, Boxall KJ, Burke R, Sun C, Avery S, Bush K, Henley A, Raynaud FI, Workman P, Bayliss R, Linardopoulos S, Blagg J. Bavetsias V, et al. Among authors: brown n. J Med Chem. 2013 Nov 27;56(22):9122-35. doi: 10.1021/jm401115g. Epub 2013 Nov 6. J Med Chem. 2013. PMID: 24195668 Free PMC article.
De novo molecular design and generative models.
Meyers J, Fabian B, Brown N. Meyers J, et al. Among authors: brown n. Drug Discov Today. 2021 Nov;26(11):2707-2715. doi: 10.1016/j.drudis.2021.05.019. Epub 2021 Jun 1. Drug Discov Today. 2021. PMID: 34082136 Free article. Review.
Optimization of imidazo[4,5-b]pyridine-based kinase inhibitors: identification of a dual FLT3/Aurora kinase inhibitor as an orally bioavailable preclinical development candidate for the treatment of acute myeloid leukemia.
Bavetsias V, Crumpler S, Sun C, Avery S, Atrash B, Faisal A, Moore AS, Kosmopoulou M, Brown N, Sheldrake PW, Bush K, Henley A, Box G, Valenti M, de Haven Brandon A, Raynaud FI, Workman P, Eccles SA, Bayliss R, Linardopoulos S, Blagg J. Bavetsias V, et al. Among authors: brown n. J Med Chem. 2012 Oct 25;55(20):8721-34. doi: 10.1021/jm300952s. Epub 2012 Oct 8. J Med Chem. 2012. PMID: 23043539 Free PMC article.
On the origins of three-dimensionality in drug-like molecules.
Meyers J, Carter M, Mok NY, Brown N. Meyers J, et al. Among authors: brown n. Future Med Chem. 2016 Sep;8(14):1753-67. doi: 10.4155/fmc-2016-0095. Epub 2016 Aug 30. Future Med Chem. 2016. PMID: 27572621 Free PMC article.
4,371 results