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Turning high-throughput structural biology into predictive inhibitor design.
Saar KL, McCorkindale W, Fearon D, Boby M, Barr H, Ben-Shmuel A; COVID Moonshot Consortium; London N, von Delft F, Chodera JD, Lee AA. Saar KL, et al. Among authors: london n. Proc Natl Acad Sci U S A. 2023 Mar 14;120(11):e2214168120. doi: 10.1073/pnas.2214168120. Epub 2023 Mar 6. Proc Natl Acad Sci U S A. 2023. PMID: 36877844 Free PMC article.
Rapid Covalent-Probe Discovery by Electrophile-Fragment Screening.
Resnick E, Bradley A, Gan J, Douangamath A, Krojer T, Sethi R, Geurink PP, Aimon A, Amitai G, Bellini D, Bennett J, Fairhead M, Fedorov O, Gabizon R, Gan J, Guo J, Plotnikov A, Reznik N, Ruda GF, Díaz-Sáez L, Straub VM, Szommer T, Velupillai S, Zaidman D, Zhang Y, Coker AR, Dowson CG, Barr HM, Wang C, Huber KVM, Brennan PE, Ovaa H, von Delft F, London N. Resnick E, et al. Among authors: london n. J Am Chem Soc. 2019 Jun 5;141(22):8951-8968. doi: 10.1021/jacs.9b02822. Epub 2019 May 22. J Am Chem Soc. 2019. PMID: 31060360 Free PMC article.
Overcoming insecticide resistance through computational inhibitor design.
Correy GJ, Zaidman D, Harmelin A, Carvalho S, Mabbitt PD, Calaora V, James PJ, Kotze AC, Jackson CJ, London N. Correy GJ, et al. Among authors: london n. Proc Natl Acad Sci U S A. 2019 Oct 15;116(42):21012-21021. doi: 10.1073/pnas.1909130116. Epub 2019 Oct 1. Proc Natl Acad Sci U S A. 2019. PMID: 31575743 Free PMC article.
Crowdsourcing drug discovery for pandemics.
Chodera J, Lee AA, London N, von Delft F. Chodera J, et al. Among authors: london n. Nat Chem. 2020 Jul;12(7):581. doi: 10.1038/s41557-020-0496-2. Nat Chem. 2020. PMID: 32555379 No abstract available.
Structural basis for producing selective MAP2K7 inhibitors.
Murakawa Y, Valter S, Barr H, London N, Kinoshita T. Murakawa Y, et al. Among authors: london n. Bioorg Med Chem Lett. 2020 Nov 15;30(22):127546. doi: 10.1016/j.bmcl.2020.127546. Epub 2020 Sep 12. Bioorg Med Chem Lett. 2020. PMID: 32931911
Crystallographic and electrophilic fragment screening of the SARS-CoV-2 main protease.
Douangamath A, Fearon D, Gehrtz P, Krojer T, Lukacik P, Owen CD, Resnick E, Strain-Damerell C, Aimon A, Ábrányi-Balogh P, Brandão-Neto J, Carbery A, Davison G, Dias A, Downes TD, Dunnett L, Fairhead M, Firth JD, Jones SP, Keeley A, Keserü GM, Klein HF, Martin MP, Noble MEM, O'Brien P, Powell A, Reddi RN, Skyner R, Snee M, Waring MJ, Wild C, London N, von Delft F, Walsh MA. Douangamath A, et al. Among authors: london n. Nat Commun. 2020 Oct 7;11(1):5047. doi: 10.1038/s41467-020-18709-w. Nat Commun. 2020. PMID: 33028810 Free PMC article.
Tunable Methacrylamides for Covalent Ligand Directed Release Chemistry.
Reddi RN, Resnick E, Rogel A, Rao BV, Gabizon R, Goldenberg K, Gurwicz N, Zaidman D, Plotnikov A, Barr H, Shulman Z, London N. Reddi RN, et al. Among authors: london n. J Am Chem Soc. 2021 Apr 7;143(13):4979-4992. doi: 10.1021/jacs.0c10644. Epub 2021 Mar 24. J Am Chem Soc. 2021. PMID: 33761747 Free PMC article.
A white-knuckle ride of open COVID drug discovery.
von Delft F, Calmiano M, Chodera J, Griffen E, Lee A, London N, Matviuk T, Perry B, Robinson M, von Delft A. von Delft F, et al. Among authors: london n. Nature. 2021 Jun;594(7863):330-332. doi: 10.1038/d41586-021-01571-1. Nature. 2021. PMID: 34127864 No abstract available.
660 results