• Search Research Projects
  • Search Researchers
  • How to Use
  1. Back to previous page

Development of novel algorithm for quality control of metabolomics data

Research Project

Project/Area Number 17K00416
Research Category

Grant-in-Aid for Scientific Research (C)

Allocation TypeMulti-year Fund
Section一般
Research Field Life / Health / Medical informatics
Research InstitutionTokyo Medical University

Principal Investigator

Sugimoto Masahiro  東京医科大学, 医学部, 教授 (30458963)

Project Period (FY) 2017-04-01 – 2020-03-31
Project Status Completed (Fiscal Year 2019)
Budget Amount *help
¥4,680,000 (Direct Cost: ¥3,600,000、Indirect Cost: ¥1,080,000)
Fiscal Year 2019: ¥1,040,000 (Direct Cost: ¥800,000、Indirect Cost: ¥240,000)
Fiscal Year 2018: ¥1,300,000 (Direct Cost: ¥1,000,000、Indirect Cost: ¥300,000)
Fiscal Year 2017: ¥2,340,000 (Direct Cost: ¥1,800,000、Indirect Cost: ¥540,000)
Keywordsメタボローム / ソフトウェア / 人工知能 / メタボーローム / ソフトウエア学
Outline of Final Research Achievements

This study aimed to develop a novel tool to analyze metabolomic data produced by a mass spectrometry. First, a complementary tool to analyze the feature or raw data, accommodating various types of mass spectrometry, which can optimize the options of subsequent automatic data processing. The developed program further optimizes the options of each step of the analyses based on the overlaid datasets. Therefore, a user is require to prepare a manually curated data (a training data). The program processes the other samples according to the training data. This algorithm functions for any types of data and enable high throughput non-targeted metabolomic analyses.

Academic Significance and Societal Importance of the Research Achievements

本研究は代謝物を網羅的に測定するメタボローム解析のデータ解析を自動化させることが目的である。測定データに含まれる全てのシグナルを正確に処理して、疾患マーカーの探索や生体の代謝の理解ができることが望ましいが、実際に完全な自動化ができているソフトウェアがなく、熟練技術者の品質制御・評価が必要となり、データ解析がボトルネックになっている。そこで熟練技術者の作業と評価基準を再現して自動的にデータ解析することができるアルゴリズムや関連するソフトを開発した。本手法は特定の機器やメーカー等に依存せず広く使用でき、本研究成果によりメタボロームを用いた臨床研究や創薬などの様々な応用研究が加速できると考えられる。

Report

(4 results)
  • 2019 Annual Research Report   Final Research Report ( PDF )
  • 2018 Research-status Report
  • 2017 Research-status Report

Research Products

(51 results)

All 2020 2019 2018 2017 Other

All Int'l Joint Research Journal Article Presentation Book

  • [Int'l Joint Research] Sheikh Mujibur Rahman University/Bioinformatics Lab(バングラディッシュ)

    • Related Report
      2017 Research-status Report
  • [Journal Article] Relationships between plasma lipidomic profiles and brown adipose tissue density in humans2020

    • Author(s)
      Fuse Sayuri、Sugimoto Masahiro、Kurosawa Yuko、Kuroiwa Miyuki、Aita Yasuko、Tomita Atsumi、Yamaguchi Eri、Tanaka Riki、Endo Tasuki、Kime Ryotaro、Hamaoka Takafumi
    • Journal Title

      International Journal of Obesity

      Volume: -

    • DOI

      10.1038/s41366-020-0558-y

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] Sensory properties and metabolomic profiles of dry-cured ham during the ripening process2020

    • Author(s)
      Sugimoto Masahiro、Sugawara Tetsuya、Obiya Shinichi、Enomoto Ayame、Kaneko Miku、Ota Sana、Soga Tomoyoshi、Tomita Masaru
    • Journal Title

      Food Research International

      Volume: 129 Pages: 108850-108850

    • DOI

      10.1016/j.foodres.2019.108850

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Promoter-Level Transcriptome Identifies Stemness Associated With Relatively High Proliferation in Pancreatic Cancer Cells2020

    • Author(s)
      Ru Chen, Aiko Sugiyama, Naoyuki Kataoka, Masahiro Sugimoto, Shoko Yokoyama, Akihisa Fukuda, Shigeo Takaishi, Hiroshi Seno
    • Journal Title

      Frontiers in Oncology

      Volume: 10 Pages: 1-14

    • DOI

      10.3389/fonc.2020.00316

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] High-resolution imaging mass spectrometry combined with transcriptomic analysis identified a link between fatty acid composition of phosphatidylinositols and the immune checkpoint pathway at the primary tumour site of breast cancer2020

    • Author(s)
      Kawashima M, Tokiwa M, Nishimura T, Kawata Y, Sugimoto M, Kataoka TR, Sakurai T, Iwaisako K, Suzuki E, Hagiwara M, Harris AL, Toi M.
    • Journal Title

      Br J Cancer

      Volume: 122 Pages: 245-257

    • DOI

      10.1038/s41416-019-0662-8

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Open Access / Int'l Joint Research
  • [Journal Article] Metabolomic profiling reveals salivary hypotaurine as a potential early detection marker for medication-related osteonecrosis of the jaw2019

    • Author(s)
      Wakako Yatsuoka,Takao Ueno et al
    • Journal Title

      PLOS ONE

      Volume: 12 Pages: 1-12

    • DOI

      10.1371/journal.pone.0220712

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] Identification of modules and functional analysis in CRC subtypes by integrated bioinformatics analysis2019

    • Author(s)
      Chen Ru、Sugiyama Aiko、Seno Hiroshi、Sugimoto Masahiro
    • Journal Title

      PLOS ONE

      Volume: 14

    • DOI

      10.1371/journal.pone.0221772

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] Salivary metabolomics with alternative decision tree-based machine learning methods for breast cancer discrimination2019

    • Author(s)
      Murata Takeshi、Yanagisawa Takako、Kurihara Toshiaki、Kaneko Miku、Ota Sana、Enomoto Ayame、Tomita Masaru、Sugimoto Masahiro、Sunamura Makoto、Hayashida Tetsu、Kitagawa Yuko、Jinno Hiromitsu
    • Journal Title

      Breast Cancer Research and Treatment

      Volume: 177 Pages: 591-601

    • DOI

      10.1007/s10549-019-05330-9

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] Discrimination of oral squamous cell carcinoma from oral lichen planus by salivary metabolomics2019

    • Author(s)
      Ishikawa Shigeo、Sugimoto Masahiro、Edamatsu Kaoru、Sugano Ayako、Kitabatake Kenichiro、Iino Mitsuyoshi
    • Journal Title

      Oral Diseases

      Volume: 26 Pages: 35-42

    • DOI

      10.1111/odi.13209

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] Association between dyslipidemia and plasma levels of branched-chain amino acids in the Japanese population without diabetes mellitus2019

    • Author(s)
      Keiko Fukushima, Sei Harada, Ayano Takeuchi, Ayako Kurihara, Miho Iida, Kota Fukai, Kazuyo Kuwabara, Suzuka Kato, Minako Matsumoto, Aya Hirata, Miki Akiyama, Masaru Tomita, Akiyoshi Hirayama, Asako Sato, Chizuru Suzuki, Masahiro Sugimoto, Tomoyoshi Soga, Daisuke Sugiyama, Tomonori Okamura, Toru Takebayashi
    • Journal Title

      Journal of Clinical Lipidology

      Volume: 13

    • DOI

      10.1016/j.jacl.2019.09.002

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Open Access / Int'l Joint Research
  • [Journal Article] Elastic net-based prediction of IFN-β treatment response of patients with multiple sclerosis using time series microarray gene expression profiles2019

    • Author(s)
      Fukushima Arika、Sugimoto Masahiro、Hiwa Satoru、Hiroyasu Tomoyuki
    • Journal Title

      Scientific Reports

      Volume: 9 Pages: 1-11

    • DOI

      10.1038/s41598-018-38441-2

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Open Access
  • [Journal Article] Identification of salivary metabolites for oral squamous cell carcinoma and oral epithelial dysplasia screening from persistent suspicious oral mucosal lesions2019

    • Author(s)
      Ishikawa Shigeo、Wong David T. W.、Sugimoto Masahiro、Gleber-Netto Frederico Omar、Li Feng、Tu Michael、Zhang Yong、Akin David、Iino Mitsuyoshi
    • Journal Title

      Clinical Oral Investigations

      Volume: ‐ Pages: 3557-3563

    • DOI

      10.1007/s00784-018-2777-3

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Effects of inter-day and intra-day variation on salivary metabolomic profiles2019

    • Author(s)
      Kawanishi Norishige、Hoshi Noriyuki、Masahiro Sugimoto、Enomoto Ayame、Ota Sana、Kaneko Miku、Soga Tomoyoshi、Tomita Masaru、Kimoto Katsuhiko
    • Journal Title

      Clinica Chimica Acta

      Volume: 489 Pages: 41-48

    • DOI

      10.1016/j.cca.2018.11.030

    • Related Report
      2018 Research-status Report
    • Peer Reviewed
  • [Journal Article] Changes in Metabolic Profiles of Human Oral Cells by Benzylidene Ascorbates and Eugenol.2018

    • Author(s)
      Sakagami Hiroshi、Sugimoto Masahiro、Kanda Yumiko、Murakami Yukio、Amano Osamu、Saitoh Junko、Kochi Atsuko
    • Journal Title

      Medicines (Basel)

      Volume: 5 Pages: 116-116

    • DOI

      10.3390/medicines5040116

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Open Access
  • [Journal Article] Gene expression profile of peripheral blood mononuclear cells may contribute to the identification and immunological classification of breast cancer patients2018

    • Author(s)
      Suzuki Eiji、Sugimoto Masahiro、Kawaguchi Kosuke、Pu Fengling、Uozumi Ryuji、Yamaguchi Ayane、Nishie Mariko、Tsuda Moe、Kotake Takeshi、Morita Satoshi、Toi Masakazu
    • Journal Title

      Breast Cancer

      Volume: 26 Pages: 282-289

    • DOI

      10.1007/s12282-018-0920-2

    • Related Report
      2018 Research-status Report
    • Peer Reviewed
  • [Journal Article] A metabolomic-based evaluation of the role of commensal microbiota throughout the gastrointestinal tract in mice.2018

    • Author(s)
      Yamamoto Yuri、Nakanishi Yumiko、Murakami Shinnosuke、Aw Wanping、Tsukimi Tomoya、Nozu Ryoko、Ueno Masami、Hioki Kyoji、Nakahigashi Kenji、Hirayama Akiyoshi、Sugimoto Masahiro、Soga Tomoyoshi、Ito Mamoru、Tomita Masaru、Fukuda Shinji
    • Journal Title

      Microorganisms

      Volume: 6 Pages: 101-101

    • DOI

      10.3390/microorganisms6040101

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Open Access
  • [Journal Article] Prediction of postoperative disease-free survival and brain metastasis for HER2-positive breast cancer patients treated with neoadjuvant chemotherapy plus trastuzumab using a machine learning algorithm2018

    • Author(s)
      Takada Masahiro、Sugimoto Masahiro、Masuda Norikazu、Iwata Hiroji、Kuroi Katsumasa、Yamashiro Hiroyasu、Ohno Shinji、Ishiguro Hiroshi、Inamoto Takashi、Toi Masakazu
    • Journal Title

      Breast Cancer Research and Treatment

      Volume: 172 Pages: 611-618

    • DOI

      10.1007/s10549-018-4958-9

    • Related Report
      2018 Research-status Report
    • Peer Reviewed
  • [Journal Article] MICOP: Maximal information coefficient-based oscillation prediction to detect biological rhythms in proteomics data2018

    • Author(s)
      Iuchi Hitoshi、Sugimoto Masahiro、Tomita Masaru
    • Journal Title

      BMC Bioinformatics

      Volume: 19 Pages: 1-11

    • DOI

      10.1186/s12859-018-2257-4

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Open Access
  • [Journal Article] Liquid biopsyへの期待と限界 メタボローム解析によるliquid biopsy2018

    • Author(s)
      杉本昌弘
    • Journal Title

      医学のあゆみ

      Volume: 265 Pages: 513-516

    • Related Report
      2018 Research-status Report
  • [Journal Article] Mining Gene Expression Profile with Missing Values: An Integration of Kernel PCA and Robust Singular Values Decomposition2018

    • Author(s)
      Islam Md. Saimul、Hoque Md. Aminul、Islam Md. Sahidul、Ali Mohammad、Hossen Md. Bipul、Binyamin Md.、Merican Amir Feisal、Akazawa Kohei、Kumar Nishith、Sugimoto Masahiro
    • Journal Title

      Current Bioinformatics

      Volume: 14 Pages: 78-89

    • DOI

      10.2174/1574893613666180413151654

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Robust volcano plot: identification of differential metabolites in the presence of outliers2018

    • Author(s)
      Kumar Nishith、Hoque Md. Aminul、Sugimoto Masahiro
    • Journal Title

      BMC Bioinformatics

      Volume: 19 Pages: 1-11

    • DOI

      10.1186/s12859-018-2117-2

    • Related Report
      2017 Research-status Report
    • Peer Reviewed / Open Access / Int'l Joint Research
  • [Journal Article] Reliability of plasma polar metabolite concentrations in a large-scale cohort study using capillary electrophoresis-mass spectrometry.2018

    • Author(s)
      Harada Sei、Hirayama Akiyoshi、Chan Queenie、Kurihara Ayako、Fukai Kota、Iida Miho、Kato Suzuka、Sugiyama Daisuke、Kuwabara Kazuyo、Takeuchi Ayano、Akiyama Miki、Okamura Tomonori、Ebbels Timothy M. D.、Elliott Paul、Tomita Masaru、Sato Asako、Suzuki Chizuru、Sugimoto Masahiro、Soga Tomoyoshi、Takebayashi Toru
    • Journal Title

      PLOS One

      Volume: 13

    • DOI

      10.1371/journal.pone.0191230

    • Related Report
      2017 Research-status Report
    • Peer Reviewed / Open Access / Int'l Joint Research
  • [Presentation] Machine learning enabled breast cancer detection using salivary metabolomics2020

    • Author(s)
      杉本昌弘
    • Organizer
      Annual Congress on Advances in Biotechnology
    • Related Report
      2019 Annual Research Report
    • Int'l Joint Research
  • [Presentation] Toward a high-quality non-targeted analysis of large metabolomics data2019

    • Author(s)
      Masahiro Sugimoto、Rintaro Saito、Tomoyoshi Soga、Masaru Tomita、Toru Takebayashi
    • Organizer
      Metabolomics 2019
    • Related Report
      2019 Annual Research Report
    • Int'l Joint Research
  • [Presentation] Metabolomic profiling of orbital lymphoproliferative diseases2019

    • Author(s)
      Eri Yamaguchi、Hiroyuki Shimizu、Yasuko Aita、Atsumi Tomita、Yoshihiko Usui、Hiroshi Goto、Masahiro Sugimoto
    • Organizer
      Metabolomics 2019
    • Related Report
      2019 Annual Research Report
    • Int'l Joint Research
  • [Presentation] 大規模データ解析の自動処理2019

    • Author(s)
      杉本昌弘、斎藤輪太郎
    • Organizer
      第13回メタボロームシンポジウム
    • Related Report
      2019 Annual Research Report
  • [Presentation] 眼窩リンパ増殖性疾患の脂溶性物質ノンターゲット解析2019

    • Author(s)
      相田泰子、清水博之、富田淳美、山口えり、杉本昌弘
    • Organizer
      第13回メタボロームシンポジウム
    • Related Report
      2019 Annual Research Report
  • [Presentation] メタボロームはなぜこれほど再現性がないのか?2019

    • Author(s)
      杉本昌弘
    • Organizer
      第44回日本医用マススペクトル学会年会
    • Related Report
      2019 Annual Research Report
    • Invited
  • [Presentation] Development of automatic analysis and quality control of mass spectrometry-based metabolome data2019

    • Author(s)
      相田泰子、杉本昌弘
    • Organizer
      CBI学会2019年大会
    • Related Report
      2019 Annual Research Report
  • [Presentation] Machine learning methods with salivary metabolomics for breast cancer detection2019

    • Author(s)
      Takeshi Murata、Takako Yanagisawa、Toshiaki Kurihara、Miku Kaneko、Ota Sana、Ayame Enomoto、Masaru Tomita、Masahiro Sugimoto、Makoto Sunamura、Tetsu Hayashida、Yuko Kitagawa、Hiromitsu Jinno
    • Organizer
      ASCO 2019
    • Related Report
      2019 Annual Research Report
    • Int'l Joint Research
  • [Presentation] 機械学習法を用いた唾液メタボローム解析による乳癌スクリーニング Machine learning models with salivary metabolites for breast cancer screening.2019

    • Author(s)
      村田健、柳澤 貴子、栗原 俊明、杉本 昌弘、砂村 眞琴、林田 哲、北川 雄光、神野 浩光
    • Organizer
      第57回日本癌治療学会学術集会
    • Related Report
      2019 Annual Research Report
  • [Presentation] 代謝はがんにとって、ドライバーか、レシーバーか?2019

    • Author(s)
      杉本昌弘
    • Organizer
      医学総合研究所 年次研究発表会
    • Related Report
      2019 Annual Research Report
  • [Presentation] 人工知能とメタボローム解析を用いた肺癌新規バイオマーカーの創出2019

    • Author(s)
      梶原直央、垣花昌俊、前田純一、前原幸夫、嶋田善久、萩原優、大平達夫、杉本昌弘、池田徳彦
    • Organizer
      第36回日本呼吸器外科学会総会
    • Related Report
      2019 Annual Research Report
  • [Presentation] 高次元解析技術を用いた肺癌予後におけるAI予測2019

    • Author(s)
      梶原直央、垣花昌俊、前田純一、前原幸夫、嶋田善久、萩原優、大平達夫、杉本昌弘、池田徳彦
    • Organizer
      第119回日本外科学会定期学術集会
    • Related Report
      2019 Annual Research Report
  • [Presentation] 高次元解析技術を用いた肺癌予後 におけるAI予測 Prediction of lung cancer prognosis using metabolomics and artificial intelligence.2019

    • Author(s)
      梶原直央、垣花昌俊、前田純一、前原幸夫、嶋田善久、萩原 優、大平達夫、杉本昌弘、池田徳彦
    • Organizer
      第20回世界肺癌学会議 IASLC WCLC 2019 Conference
    • Related Report
      2019 Annual Research Report
    • Int'l Joint Research
  • [Presentation] 肺癌における代謝異常のメカニズムに基づく予後予測 The prediction of prognosis in lung cancer based on the mechanism of metabolic abnormalities.2019

    • Author(s)
      梶原直央、垣花昌俊、工藤勇人、牧野洋二郎、前原幸夫、嶋田善久、萩原 優、大平達夫、杉本昌弘、池田徳彦
    • Organizer
      第72回日本胸部外科学会定期学術集会
    • Related Report
      2019 Annual Research Report
  • [Presentation] 唾液から見える全身の代謝異常2019

    • Author(s)
      杉本昌弘
    • Organizer
      日本がん口腔支持療法学会 第5回学術大会
    • Related Report
      2019 Annual Research Report
  • [Presentation] Salivary Metabolomics for Colorectal Cancer Detection2019

    • Author(s)
      Hiroshi Kuwabara、Kenji Katsumata、Yoshiko Soya、Takahiro Wada、Takaaki Matsudo、Masanobu Enomoto、Tetsuo Ishizaki、Yuichi Nagakawa、Akihiko Tsuchida1、Masahiro Sugimoto
    • Organizer
      ESMO Congress 2019
    • Related Report
      2019 Annual Research Report
    • Int'l Joint Research
  • [Presentation] 唾液メタボローム解析による薬剤関連顎骨壊死特異物質の探索2019

    • Author(s)
      八岡和歌子、上野尚雄、宮野加奈子、上園保仁、榎本文芽、金子未来、太田紗菜、曽我朋義、杉本昌弘、牛島俊和
    • Organizer
      第24回日本緩和医療学会学術大会
    • Related Report
      2019 Annual Research Report
  • [Presentation] 非小細胞肺癌における発現変動遺伝子群のクラスタリングから得られたセントロイド間の関係2019

    • Author(s)
      三須滉、杉本昌弘、佐々木貴規
    • Organizer
      第19回日本蛋白質科学会年会
    • Related Report
      2019 Annual Research Report
  • [Presentation] Machine learning and urinary polyamines to detect colorectal cancers2018

    • Author(s)
      Masahiro Sugimoto
    • Organizer
      Metabolomics2018
    • Related Report
      2018 Research-status Report
    • Int'l Joint Research
  • [Presentation] Stability of polyamine concentrations in saliva2018

    • Author(s)
      Atsumi Tomita, Eri Yamaguchi, Masahiro Sugimoto
    • Organizer
      Metabolomics2018
    • Related Report
      2018 Research-status Report
    • Int'l Joint Research
  • [Presentation] Artificial intelligence-based colorectal cancer screening using urinary polyamines.2018

    • Author(s)
      杉本昌弘
    • Organizer
      第77回日本癌学会学術総会
    • Related Report
      2018 Research-status Report
  • [Presentation] ~痛みが少なく採取できる体液で疾患検査~ Low invasively available biofluid enables disease detection2018

    • Author(s)
      杉本昌弘
    • Organizer
      BIO tech2018
    • Related Report
      2018 Research-status Report
  • [Presentation] Trastuzumabを含む術前化学療法を施行されたHER2陽性原発性乳癌の予後予測数理モデルの開発2018

    • Author(s)
      杉本昌弘, 髙田正泰, 増田慎三, 岩田広治, 黒井克昌, 山城大泰, 大野真司, 石黒洋, 稲本俊, 戸井雅和
    • Organizer
      第26回日本乳癌学会学術総会
    • Related Report
      2018 Research-status Report
  • [Presentation] AIを活用した医療情報解析2018

    • Author(s)
      杉本昌弘
    • Organizer
      平成30年度唾液腺コアミーティング
    • Related Report
      2018 Research-status Report
  • [Presentation] 網羅的な分子マーカー探索による低侵襲医療の実現化2018

    • Author(s)
      杉本昌弘
    • Organizer
      BIO tech2018
    • Related Report
      2018 Research-status Report
  • [Presentation] 褐色脂肪組織の活性化要因の探索2018

    • Author(s)
      黒澤裕子, 布施沙由理, 木目良太郎, 杉本昌弘, 長井美穂, 菅野義彦, 浜岡隆文
    • Organizer
      東京医科大学研究ブランディング事業キックオフシンポジウム
    • Related Report
      2018 Research-status Report
  • [Book] 早期発見・予防に向けた次世代がん検査技術の最前線2019

    • Author(s)
      杉本昌弘
    • Total Pages
      216
    • Publisher
      シーエムシー出版
    • Related Report
      2018 Research-status Report
  • [Book] 実験医学2018

    • Author(s)
      杉本昌弘
    • Total Pages
      3335
    • Publisher
      羊土社
    • Related Report
      2018 Research-status Report
  • [Book] Health Informatics Data Analysis2017

    • Author(s)
      Sugimoto Masahiro
    • Total Pages
      210
    • Publisher
      Springer International Publishing
    • Related Report
      2017 Research-status Report

URL: 

Published: 2017-04-28   Modified: 2021-02-19  

Information User Guide FAQ News Terms of Use Attribution of KAKENHI

Powered by NII kakenhi