[27-09-am] Drug Discovery, SAR 1/Drug Seeds, Screening 1/Drug design 1 | The 145th Annual Meeting of the Pharmaceutical Society of Japan (Fukuoka)

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Session Details

Oral Presentation(A) Pharmaceutical Chemistry

[27-09-am]Drug Discovery, SAR 1/Drug Seeds, Screening 1/Drug design 1

Thu. Mar 27, 2025 10:04 AM - 11:45 AM JST
Thu. Mar 27, 2025 1:04 AM - 2:45 AM UTC

Room 9 (Fukuoka International Congress Center: 411 [4F])

Chair: Watanabe Mizuki, Akira Shigenaga

10:04 AM - 10:16 AM JST(1:04 AM - 1:16 AM UTC)

[27-09-am08]Development of Explainable Prediction Models for CYP inhibition

○Kazuma Kaitoh¹, Yoshihiro Yamanishi¹ (1. Nagoya Univ.)

10:16 AM - 10:28 AM JST(1:16 AM - 1:28 AM UTC)

[27-09-am09]Generative AI-Driven Redesign of Lapatinib: A Case Study in Overcoming hERG Cardiotoxicity

○Khaled Barakat¹, Bell Tommy¹, Samiuddin Zainab¹ (1. University of Alberta, College of Health Sciences, Faculty of Pharmacy and Pharmaceutical Sciences)

10:28 AM - 10:40 AM JST(1:28 AM - 1:40 AM UTC)

[27-09-am10]Development of a Carcinogenicity Prediction Method for Nitrosamines by Integrating Quantum Chemical Calculations and Machine Learning

○Kazuteru Usui¹, Shota Matsumoto¹, Yosuke Demizu², Satoru Karasawa¹ (1. Faculty of Pharm. Sci., Showa Pharm. Univ, 2. Natl. Inst. Health Sci)

10:40 AM - 10:52 AM JST(1:40 AM - 1:52 AM UTC)

[27-09-am11]Development of a machine learning QSAR predictive model for exploring potential therapeutic agents for glioblastoma

○Shuhei Nakao¹, Yuki Uemichi¹, Miyuu Niki¹, Miyuki Mabuchi¹, Shuji Nagano¹, Yoshihiro Uesawa², Tadashi Shimizu¹ (1. Sch. Pharm. Hyogo Medical Univ., 2. Meiji Pharmaceutical Univ.)

10:52 AM - 10:57 AM JST(1:52 AM - 1:57 AM UTC)

Break

10:57 AM - 11:09 AM JST(1:57 AM - 2:09 AM UTC)

[27-09-am12]Development and biological activity evaluation of cRGDTFI, a cyclic peptide with potent integrin-binding activity

○Yuji Yamada¹, Mitsuhiro Takeda¹, Seiya Ohki¹, Masumi Matsunuma¹, Masaki Mishima¹, Tomomi Furihata¹, Keisuke Hamada¹, Yamato Kikkawa¹, Motoyoshi Nomizu¹ (1. Sch. Pharm., Tokyo Univ. Pharm. Life Sci.)

11:09 AM - 11:21 AM JST(2:09 AM - 2:21 AM UTC)

[27-09-am13]Development of p53/MDM2 inhibitor peptides via reversible covalent bond formation

○Naoki Umezawa¹, Taku Hirose¹, Hana Murabayashi², Yosuke Hisamatsu¹ (1. Grad. Sch. Pharm. Sci., Nagoya City Univ., 2. Faculty of Pharm. Sci., Nagoya City Univ.)

11:21 AM - 11:33 AM JST(2:21 AM - 2:33 AM UTC)

[27-09-am14]Structure derivatization of IgG binding peptide and analysis of their secondary structure by circular dichroism spectroscopy

○kyohei muguruma¹, Akane Fukuda², Hayate Shida², Taguchi Akihiro², Kentaro Takayama³, Atsuhiko Taniguchi², Yuji Ito⁴, Yoshio Hayashi^2,5 (1. Lab. Chem. Life Sci., Science Tokyo, 2. Grad. Sch. Pharm., Tokyo Univ. Pharm. Life Sci., 3. Kyoto Pharm. Univ., 4. Kagoshima Univ., 5. Sch. Life Sci., Tokyo Univ. Pharm. Life Sci.)

11:33 AM - 11:45 AM JST(2:33 AM - 2:45 AM UTC)

[27-09-am15]Design and Functional Evaluation of Monobody Derivatives

○Naoya Iwamoto^1,2, Saya Ohno¹, Kensuke Nakamura¹, Toshinori Naito³, Sayaka Miura³, Shinsuke Inuki¹, Hiroaki Ohno¹, Gosuke Hayashi³, Hiroshi Murakami³, Shinya Oishi^1,2 (1. Kyoto Pharm. Univ., 2. Grad. Sch. Pharm. Sci., 3. Grad. Sch. Eng.)

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