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Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX).
Bentley MR, Ilyichova OV, Wang G, Williams ML, Sharma G, Alwan WS, Whitehouse RL, Mohanty B, Scammells PJ, Heras B, Martin JL, Totsika M, Capuano B, Doak BC, Scanlon MJ. Bentley MR, et al. Among authors: mohanty b. J Med Chem. 2020 Jul 9;63(13):6863-6875. doi: 10.1021/acs.jmedchem.0c00111. Epub 2020 Jun 24. J Med Chem. 2020. PMID: 32529824
The structure of integrin α1I domain in complex with a collagen-mimetic peptide.
Chin YK, Headey SJ, Mohanty B, Patil R, McEwan PA, Swarbrick JD, Mulhern TD, Emsley J, Simpson JS, Scanlon MJ. Chin YK, et al. Among authors: mohanty b. J Biol Chem. 2013 Dec 27;288(52):36796-809. doi: 10.1074/jbc.M113.480251. Epub 2013 Nov 1. J Biol Chem. 2013. PMID: 24187131 Free PMC article.
Application of fragment-based screening to the design of inhibitors of Escherichia coli DsbA.
Adams LA, Sharma P, Mohanty B, Ilyichova OV, Mulcair MD, Williams ML, Gleeson EC, Totsika M, Doak BC, Caria S, Rimmer K, Horne J, Shouldice SR, Vazirani M, Headey SJ, Plumb BR, Martin JL, Heras B, Simpson JS, Scanlon MJ. Adams LA, et al. Among authors: mohanty b. Angew Chem Int Ed Engl. 2015 Feb 9;54(7):2179-84. doi: 10.1002/anie.201410341. Epub 2014 Dec 30. Angew Chem Int Ed Engl. 2015. PMID: 25556635
Promiscuous 2-aminothiazoles (PrATs): a frequent hitting scaffold.
Devine SM, Mulcair MD, Debono CO, Leung EW, Nissink JW, Lim SS, Chandrashekaran IR, Vazirani M, Mohanty B, Simpson JS, Baell JB, Scammells PJ, Norton RS, Scanlon MJ. Devine SM, et al. Among authors: mohanty b. J Med Chem. 2015 Feb 12;58(3):1205-14. doi: 10.1021/jm501402x. Epub 2015 Jan 16. J Med Chem. 2015. PMID: 25559643
661 results