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Glob. Antimicrob. Resist.<\/i>, <b>24<\/b>, 81\u201382 (2021).","DOI":"10.1016\/j.jgar.2020.11.022"},{"key":"13","doi-asserted-by":"crossref","unstructured":"13) Syed Y. Y., <i>Drugs<\/i>, <b>82<\/b>, 455\u2013460 (2022).","DOI":"10.1007\/s40265-022-01684-5"},{"key":"14","doi-asserted-by":"crossref","unstructured":"14) Unoh Y., Uehara S., Nakahara K., <i>et al.<\/i>, <i>J. Med. Chem.<\/i>, <b>65<\/b>, 6499\u20136512 (2022).","DOI":"10.1021\/acs.jmedchem.2c00117"},{"key":"15","doi-asserted-by":"crossref","unstructured":"15) Xie Y., Choi T., Al-Aly Z., <i>JAMA Intern. Med.<\/i>, <b>183<\/b>, 554\u2013564 (2023).","DOI":"10.1001\/jamainternmed.2023.0743"},{"key":"16","doi-asserted-by":"crossref","unstructured":"16) Shin D., Mukherjee R., Grewe D., <i>et al.<\/i>, <i>Nature<\/i> (London), <b>587<\/b>, 657\u2013662 (2020).","DOI":"10.1038\/s41586-020-2601-5"},{"key":"17","doi-asserted-by":"crossref","unstructured":"17) Ratia K., Pegan S., Takayama J., Sleeman K., Coughlin M., Baliji S., Chaudhuri R., Fu W., Prabhakar B. S., Johnson M. E., Baker S. C., Ghosh A. K., Mesecar A. D., <i>Proc. Natl. Acad. Sci. U.S.A.<\/i>, <b>105<\/b>, 16119\u201316124 (2008).","DOI":"10.1073\/pnas.0805240105"},{"key":"18","doi-asserted-by":"crossref","unstructured":"18) Freitas B. T., Durie I. A., Murray J., Longo J. E., Miller H. C., Crich D., Hogan R. J., Tripp R. A., Pegan S. D., <i>ACS Infect. Dis.<\/i>, <b>6<\/b>, 2099\u20132109 (2020).","DOI":"10.1021\/acsinfecdis.0c00168"},{"key":"19","doi-asserted-by":"crossref","unstructured":"19) Shan H., Liu J., Shen J., Dai J., Xu G., Lu K., Han C., Wang Y., Xu X., Tong Y., Xiang H., Ai Z., Zhuang G., Hu J., Zhang Z., Li Y., Pan L., Tan L., <i>Cell Chem. Biol.<\/i>, <b>28<\/b>, 855\u2013865.e9 (2021).","DOI":"10.1016\/j.chembiol.2021.04.020"},{"key":"20","doi-asserted-by":"crossref","unstructured":"20) Shen Z., Ratia K., Cooper L., Kong D., Lee H., Kwon Y., Li Y., Alqarni S., Huang F., Dubrovskyi O., Rong L., Thatcher G. R. J., Xiong R., <i>J. Med. Chem.<\/i>, <b>65<\/b>, 2940\u20132955 (2022).","DOI":"10.1021\/acs.jmedchem.1c01307"},{"key":"21","doi-asserted-by":"crossref","unstructured":"21) Ma C., Sacco M. D., Xia Z., Lambrinidis G., Townsend J. A., Hu Y., Meng X., Szeto T., Ba M., Zhang X., Gongora M., Zhang F., Marty M. T., Xiang Y., Kolocouris A., Chen Y., Wang J., <i>ACS Cent. Sci.<\/i>, <b>7<\/b>, 1245\u20131260 (2021).","DOI":"10.1021\/acscentsci.1c00519"},{"key":"22","doi-asserted-by":"crossref","unstructured":"22) Zhao Y., Du X., Duan Y., <i>et al.<\/i>, <i>Protein Cell.<\/i>, <b>12<\/b>, 877\u2013888 (2021).","DOI":"10.1007\/s13238-021-00836-9"},{"key":"23","doi-asserted-by":"crossref","unstructured":"23) Napolitano V., Dabrowska A., Schorpp K., <i>et al.<\/i>, <i>Cell Chem. Biol.<\/i>, <b>29<\/b>, 774\u2013784.e8 (2022).","DOI":"10.1016\/j.chembiol.2021.11.006"},{"key":"24","doi-asserted-by":"crossref","unstructured":"24) Ewert W., G\u00fcnther S., Miglioli F., Falke S., Reinke P. Y. A., Niebling S., G\u00fcnther C., Han H., Srinivasan V., Brognaro H., Lieske J., Lorenzen K., Garcia-Alai M. M., Betzel C., Carcelli M., Hinrichs W., Rogolino D., Meents A., <i>Front. Chem.<\/i>, <b>10<\/b>, 832431 (2022).","DOI":"10.3389\/fchem.2022.832431"},{"key":"25","doi-asserted-by":"crossref","unstructured":"25) Calleja D. J., Kuchel N., Lu B. G. C., <i>et al.<\/i>, <i>Front. Chem.<\/i>, <b>10<\/b>, 861209 (2022).","DOI":"10.3389\/fchem.2022.876212"},{"key":"26","doi-asserted-by":"crossref","unstructured":"26) Zev S., Raz K., Schwartz R., Tarabeh R., Gupta P. K., Major D. T., <i>J. Chem. Inf. Model.<\/i>, <b>61<\/b>, 2957\u20132966 (2021).","DOI":"10.1021\/acs.jcim.1c00263"},{"key":"27","doi-asserted-by":"crossref","unstructured":"27) Kamo T., Kuroda K., Kondo S., Hayashi U., Fudo S., Yoneda T., Takaya A., Nukaga M., Hoshino T., <i>Chem. Pharm. Bull.<\/i>, <b>69<\/b>, 1179\u20131183 (2021).","DOI":"10.1248\/cpb.c21-00611"},{"key":"28","doi-asserted-by":"crossref","unstructured":"28) Qu L., Fudo S., Matsuzaki K., Hoshino T., <i>Chem. Pharm. Bull.<\/i>, <b>67<\/b>, 959\u2013965 (2019).","DOI":"10.1248\/cpb.c19-00171"},{"key":"29","doi-asserted-by":"crossref","unstructured":"29) Qu L., Qiao X., Qi F., Nishida N., Hoshino T., <i>J. Chem. Inf. Model.<\/i>, <b>61<\/b>, 2396\u20132406 (2021).","DOI":"10.1021\/acs.jcim.1c00167"},{"key":"30","doi-asserted-by":"crossref","unstructured":"30) Qiao X., Qu L., Guo Y., Hoshino T., <i>J. Phys. Chem.<\/i>, <b>125<\/b>, 11374\u201311385 (2021).","DOI":"10.1021\/acs.jpcb.1c05997"},{"key":"31","doi-asserted-by":"crossref","unstructured":"31) Fuji H., Qi F., Qu L., Takaesu Y., Hoshino T., <i>Chem. Pharm. Bull.<\/i>, <b>65<\/b>, 461\u2013468 (2017).","DOI":"10.1248\/cpb.c16-00913"},{"key":"32","doi-asserted-by":"crossref","unstructured":"32) Rut W., Lv Z., Zmudzinski M., Patchett S., Nayak D., Snipas S. J., El Oualid F., Huang T. T., Bekes M., Drag M., Olsen S. K., <i>Sci. Adv.<\/i>, <b>6<\/b>, eabd4596 (2020).","DOI":"10.1126\/sciadv.abd4596"},{"key":"33","doi-asserted-by":"crossref","unstructured":"33) Maier J. A., Martinez C., Kasavajhala K., Wickstrom L., Hauser K. E., Simmerling C., <i>J. Chem. Theory Comput.<\/i>, <b>11<\/b>, 3696\u20133713 (2015).","DOI":"10.1021\/acs.jctc.5b00255"},{"key":"34","doi-asserted-by":"crossref","unstructured":"34) Daczkowski C. M., Dzimianski J. V., Clasman J. R., Goodwin O., Andrew D., Mesecar A. D., Pegan S. D., <i>J. Mol. Biol.<\/i>, <b>429<\/b>, 1661\u20131683 (2017).","DOI":"10.1016\/j.jmb.2017.04.011"},{"key":"35","doi-asserted-by":"crossref","unstructured":"35) Barretto N., Jukneliene D., Ratia K., Chen Z., Mesecar A. D., Baker S. C., <i>J. Virol.<\/i>, <b>79<\/b>, 15189\u201315198 (2005).","DOI":"10.1128\/JVI.79.24.15189-15198.2005"},{"key":"36","doi-asserted-by":"crossref","unstructured":"36) Cho C. C., Li S. G., Lalonde T. J., Yang K. S., Yu G., Qiao Y., Xu S., Ray Liu W., <i>ChemMedChem<\/i>, <b>17<\/b>, e202100455 (2022).","DOI":"10.1002\/cmdc.202200053"},{"key":"37","doi-asserted-by":"crossref","unstructured":"37) Sencanski M., Perovic V., Milicevic J., Todorovic T., Prodanovic R., Veljkovic V., Paessler S., Glisic S., <i>ChemistryOpen<\/i>, <b>11<\/b>, e202100248 (2022).","DOI":"10.1002\/open.202100248"},{"key":"38","doi-asserted-by":"crossref","unstructured":"38) Kouznetsova V. L., Zhang A., Tatineni M., Miller M. A., Tsigelny I. F., <i>Peer J.<\/i>, <b>8<\/b>, e9965 (2020).","DOI":"10.7717\/peerj.9965"},{"key":"39","doi-asserted-by":"crossref","unstructured":"39) Konno S., Kobayashi K., Senda M., <i>et al.<\/i>, <i>J. Med. Chem.<\/i>, <b>65<\/b>, 2926\u20132939 (2022).","DOI":"10.1021\/acs.jmedchem.1c00665"},{"key":"40","doi-asserted-by":"crossref","unstructured":"40) Osipiuk J., Azizi S. A., Dvorkin S., <i>et al.<\/i>, <i>Nat. Commun.<\/i>, <b>12<\/b>, 743 (2021).","DOI":"10.1038\/s41467-021-21060-3"}],"container-title":["Chemical and Pharmaceutical Bulletin"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/www.jstage.jst.go.jp\/article\/cpb\/71\/12\/71_c23-00622\/_pdf","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,12,2]],"date-time":"2023-12-02T03:34:43Z","timestamp":1701488083000},"score":1,"resource":{"primary":{"URL":"https:\/\/www.jstage.jst.go.jp\/article\/cpb\/71\/12\/71_c23-00622\/_article"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023,12,1]]},"references-count":40,"journal-issue":{"issue":"12","published-print":{"date-parts":[[2023]]}},"URL":"https:\/\/doi.org\/10.1248\/cpb.c23-00622","relation":{},"ISSN":["0009-2363","1347-5223"],"issn-type":[{"value":"0009-2363","type":"print"},{"value":"1347-5223","type":"electronic"}],"subject":[],"published":{"date-parts":[[2023,12,1]]},"article-number":"c23-00622"}}