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A prospective compound screening contest identified broader inhibitors for Sirtuin 1
https://oist.repo.nii.ac.jp/records/1409
https://oist.repo.nii.ac.jp/records/1409c418ce7a-48fc-42cc-be5f-9e8a36d78422
名前 / ファイル | ライセンス | アクション |
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s41598-019-55069-y (2.7 MB)
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Creative Commons Attribution 4.0 International(https://creativecommons.org/licenses/by/4.0/)
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Item type | 学術雑誌論文 / Journal Article(1) | |||||
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公開日 | 2020-04-27 | |||||
タイトル | ||||||
言語 | en | |||||
タイトル | A prospective compound screening contest identified broader inhibitors for Sirtuin 1 | |||||
言語 | ||||||
言語 | eng | |||||
資源タイプ | ||||||
資源タイプ識別子 | http://purl.org/coar/resource_type/c_6501 | |||||
資源タイプ | journal article | |||||
著者(英) |
Chiba, Shuntaro
× Chiba, Shuntaro× Ohue, Masahito× Gryniukova, Anastasiia× Borysko, Petro× Zozulya, Sergey× Yasuo, Nobuaki× Yoshino, Ryunosuke× Ikeda, Kazuyoshi× Shin, Woong-Hee× Kihara, Daisuke× Iwadate, Mitsuo× Umeyama, Hideaki× Ichikawa, Takaaki× Teramoto, Reiji× Hsin, Kun-Yi× Gupta, Vipul× Kitano, Hiroaki× Sakamoto, Mika× Higuchi, Akiko× Miura, Nobuaki× Yura, Kei× Mochizuki, Masahiro× Ramakrishnan, Chandrasekaran× Thangakani, A. Mary× Velmurugan, D.× Gromiha, M. Michael× Nakane, Itsuo× Uchida, Nanako× Hakariya, Hayase× Tan, Modong× Nakamura, Hironori K.× Suzuki, Shogo D.× Ito, Tomoki× Kawatani, Masahiro× Kudoh, Kentaroh× Takashina, Sakurako× Yamamoto, Kazuki Z.× Moriwaki, Yoshitaka× Oda, Keita× Kobayashi, Daisuke× Okuno, Tatsuya× Minami, Shintaro× Chikenji, George× Prathipati, Philip× Nagao, Chioko× Mohsen, Attayeb× Ito, Mari× Mizuguchi, Kenji× Honma, Teruki× Ishida, Takashi× Hirokawa, Takatsugu× Akiyama, Yutaka× Sekijima, Masakazu |
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書誌情報 |
en : Scientific Reports 巻 9, 号 1, p. 19585, 発行日 2019-12-20 |
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抄録 | ||||||
内容記述タイプ | Other | |||||
内容記述 | Potential inhibitors of a target biomolecule, NAD-dependent deacetylase Sirtuin 1, were identified by a contest-based approach, in which participants were asked to propose a prioritized list of 400 compounds from a designated compound library containing 2.5 million compounds using in silico methods and scoring. Our aim was to identify target enzyme inhibitors and to benchmark computer-aided drug discovery methods under the same experimental conditions. Collecting compound lists derived from various methods is advantageous for aggregating compounds with structurally diversified properties compared with the use of a single method. The inhibitory action on Sirtuin 1 of approximately half of the proposed compounds was experimentally accessed. Ultimately, seven structurally diverse compounds were identified. | |||||
出版者 | ||||||
出版者 | Nature Research | |||||
ISSN | ||||||
収録物識別子タイプ | ISSN | |||||
収録物識別子 | 2045-2322 | |||||
PubMed番号 | ||||||
関連タイプ | isIdenticalTo | |||||
識別子タイプ | PMID | |||||
関連識別子 | info:pmid/31863054 | |||||
DOI | ||||||
関連タイプ | isIdenticalTo | |||||
識別子タイプ | DOI | |||||
関連識別子 | info:doi/10.1038/s41598-019-55069-y | |||||
権利 | ||||||
権利情報 | © 2019 The Author(s) | |||||
情報源 | ||||||
関連名称 | https://creativecommons.org/licenses/by/4.0/ | |||||
関連サイト | ||||||
識別子タイプ | URI | |||||
関連識別子 | https://www.nature.com/articles/s41598-019-55069-y | |||||
著者版フラグ | ||||||
出版タイプ | VoR | |||||
出版タイプResource | http://purl.org/coar/version/c_970fb48d4fbd8a85 |