Yulong Gou, Suyong Re, Kenji Mizuguchi, Chioko Nagao. Impact of Hydrogen Bonding on P-Glycoprotein Efflux Transport as Revealed by Evaluation of a De Novo Prediction Model. ACS Medicinal Chemistry Letters. 2023
Kyohei Koyama, Kosuke Hashimoto, Chioko Nagao, Kenji Mizuguchi. Attention network for predicting T-cell receptor-peptide binding can associate attention with interpretable protein structural properties. Frontiers in Bioinformatics. 2023. 3
Hitoshi Kawashima, Reiko Watanabe, Tsuyoshi Esaki, Masataka Kuroda, Chioko Nagao, Yayoi Natsume-Kitatani, Rikiya Ohashi, Hiroshi Komura, Kenji Mizuguchi. DruMAP: A Novel Drug Metabolism and Pharmacokinetics Analysis Platform. Journal of Medicinal Chemistry. 2023
Yayoi Natsume-Kitatani, Mari N Itoh, Yoshito Takeda, Masataka Kuroda, Haruhiko Hirata, Kohtaro Miyake, Takayuki Shiroyama, Yuya Shirai, Yoshimi Noda, Yuichi Adachi, et al. Data-driven patient stratification and drug target discovery by using medical information and serum proteome data of idiopathic pulmonary fibrosis patients. 2022
Tsuyoshi Esaki, Reiko Watanabe, Rikiya Ohashi, Yayoi Natsume-Kitatani, Hitoshi Kawashima, Chioko Nagao, Kenji Mizuguchi. Development of a pharmacokinetics prediction system using multiscale integrated modeling: 1. In silico prediction of fraction of unbound drug in the brain homogenate. 2018 International Meeting on 22nd MDO and 33rd JSSX. 2018