SCIENCE

Patent

  • GRANTED

    Heterocyclic compound decomposing ras and uses thereof

    10-2304478

  • GRANTED

    Pharmaceutical composition for treating or preventing disease concerining Axin-GSK3 binding containing niclosamide

    10-1928543

  • GRANTED

    Pharmaceutical composition for preventing or treating familial adenomatous polyposis comprising niclosamide and metformin

    10-2102993

  • FILED

    Heterobicyclic Compound and Pharmaceutical Composition Comprising the Same

    10-2023-0094637

  • FILED

    Modulators of hippo pathway and pharmaceutical composition for treating or preventing cancer comprising the same

    01-2023-0044836

Publication

  • Hot Spot Analysis of YAP-TEAD Protein-Protein Interaction Using the Fragment Molecular Orbital Method and Its Application for Inhibitor Discovery

    Cancers (Basel). 2021 Aug 23;13(16):4246. doi: 10.3390/cancers13164246.
    Jongwan Kim, Hocheol Lim, Sungho Moon, Seon Yeon Cho, Minhye Kim, Jae Hyung Park, Hyun Woo Park , Kyoung Tai No

    PreMetabo: An in silico phase I and II drug metabolism prediction platformy

    CDrug Metabolism and Pharmacokinetics. 2020 May 31;35(4):361-367. doi: 10.1016/j.dmpk.2020.05.007
    Sungbo Hwang, Hyun Kil Shin, Seong Eun Shin, Myungwon Seo, Hyeon-Nae Jeon, Da-Eun Yim, Dong-Hyun Kim, Kyoung Tai No

    Evaluation of protein descriptors in computer-aided rational protein engineering tasks and its application in property prediction in SARS-CoV-2 spike glycoprotein

    Computational and Structural Biotechnology Journal. 2022 Jan 31;20:788-798. doi: 10.1016/j.csbj.2022.01.027
    Hocheol Lim, Hyeon-Nae Jeon, Seungcheol Lim, Yuil Jang, Taehee Kim, Hyein Cho, Jae-Gu Pan, Kyoung Tai No

    Quantum Computational study of chloride attack on chloromethane for chemical accuracy and quantum noise effects with UCCSD and k-UpCCGSD ansatzes

    Scientific Reports. 2022 May 06;12(1):7495. doi: 10.1038/s41598-022-11537-6.
    Hocheol Lim, Hyeon-Nae Jeon, June-Koo Rhee, Byungdu Oh, Kyoung Tai No

    De novo molecular design with deep molecular generative models for PPI inhibitors

    Briefings in Bioinformatics. 2022 July 14;23(4):bbac285. doi: 10.1093/bib/bbac285.
    Jianmin Wang, Yanyi Chu, Jiashun Mao, Hyeon-Nae Jeon, Haiyan Jin, Amir Zeb, Yuil Jang, Kwang-Hwi Cho, Tao Song, Kyoung Tai No

  • Transformer-Based Molecular Generative Model for Antiviral Drug Design

    Journal of Chemical Information and Modeling. 2023 June 27; doi: 10.1021/acs.jcim.3c00536
    Jiashun Mao, Jianmin Wang, Amir Zeb, Kwang-Hwi Cho, Haiyan Jin, Jongwan Kim, Onju Lee, Yunyun Wang, Kyoung Tai No

    Novel bispecific human antibody platform specifically targeting a fully open spike conformation potently neutralizes multiple SARS-CoV-2 variants

    Antiviral Research. 2023 Apr 212:105576. doi:10.1016/j.antiviral.2023.105576.
    Ji Woong Kim, Kyun Heo, Hyun Jung Kim, Youngki Yoo, Hyun-Soo Cho, Hui Jeong Jang, Ho-Young Lee, In Young Ko, Ju Rang Woo, Yea Bin Cho, Ji Hyun Lee, Ha Rim Yang, Ha Gyeong Shin, Hye Lim Choi, Kyusang Hwang, Sokho Kim, Hanseong Kim, Kwangrok Chun, Sukmook Lee

    Cryo-EM Structure determination of sub-50-kDa protein : A Case Study on Maltose Binding Protein

    The 20th International Microscopy Congress (IMC20) Poster session (2023.09.13)
    Kunwoong Park, Youngki Yoo, Kiju Choi, Hanseong Kim

    Prediction of polyreactive and nonspecific single‑chain fragment variables through structural biochemical features and protein language‑based descriptors

    BMC Bioinformatics 23, 520 (2022). https://doi.org/10.1186/s12859-022-05010-4
    Hocheol Lim and Kyoung Tai No

    Identification of Novel Natural Product Inhibitors against Matrix Metalloproteinase 9 Using Quantum Mechanical Fragment Molecular Orbital-Based Virtual Screening Methods

    Int. J. Mol. Sci. 2022, 23(8), 4438; https://doi.org/10.3390/ijms23084438
    Hocheol Lim, Hansol Hong, Seonik Hwang, Song Ja Kim, Sung Yum Seo and Kyoung Tai No