K. Hengphasatporn

发表

Halogenated Baicalein as a Promising Antiviral Agent toward SARS-CoV-2 Main Protease

T. Rungrotmongkol, Y. Shigeta, S. Hannongbua, 2022, J. Chem. Inf. Model..

Multiple Virtual Screening Strategies for the Discovery of Novel Compounds Active Against Dengue Virus: A Hit Identification Study

T. Langer, T. Rungrotmongkol, P. Wolschann, 2019 .

Design, synthesis, in vitro, in silico, and SAR studies of flavone analogs towards anti-dengue activity

T. Rungrotmongkol, Y. Shigeta, P. Maitarad, 2022, Scientific reports.

Cardol triene inhibits dengue infectivity by targeting kl loops and preventing envelope fusion

T. Rungrotmongkol, W. Chavasiri, Siwaporn Boonyasuppayakorn, 2018, Scientific Reports.

Lichen-Derived Diffractaic Acid Inhibited Dengue Virus Replication in a Cell-Based System

J. Chu, T. Rungrotmongkol, Y. Shigeta, 2023, Molecules.

The 8-bromobaicalein inhibited the replication of dengue, and Zika viruses and targeted the dengue polymerase

J. Chu, T. Rungrotmongkol, Y. Shigeta, 2023, Scientific Reports.

Alkyne-Tagged Apigenin, a Chemical Tool to Navigate Potential Targets of Flavonoid Anti-Dengue Leads

T. Rungrotmongkol, Y. Shigeta, Kowit Hengphasatporn, 2021, Molecules.

Dibromopinocembrin and Dibromopinostrobin Are Potential Anti-Dengue Leads with Mild Animal Toxicity

J. Chu, T. Rungrotmongkol, Y. Shigeta, 2020, Molecules.

Target Identification Using Homopharma and Network-Based Methods for Predicting Compounds Against Dengue Virus-Infected Cells

K. Plaimas, Jinn-Moon Yang, A. Suratanee, 2020, Molecules.

A novel flavanone derivative inhibits dengue virus fusion and infectivity

K. Ruxrungtham, T. Rungrotmongkol, P. Phuwapraisirisan, 2018, Antiviral research.

Binding pattern and susceptibility of epigallocatechin gallate against envelope protein homodimer of Zika virus: A molecular dynamics study

T. Rungrotmongkol, N. Kungwan, Kowit Hengphasatporn, 2019, Journal of Molecular Liquids.

Why Are Lopinavir and Ritonavir Effective against the Newly Emerged Coronavirus 2019? Atomistic Insights into the Inhibitory Mechanisms

Thanyada Rungrotmongkol, Supot Hannongbua, Yasuteru Shigeta, 2020, Biochemistry.

Pharmacophore-Based Virtual Screening and Experimental Validation of Pyrazolone-Derived Inhibitors toward Janus Kinases

T. Rungrotmongkol, Y. Shigeta, P. Wolschann, 2022, ACS omega.

Sulfonylated Indeno[1,2-c]quinoline Derivatives as Potent EGFR Tyrosine Kinase Inhibitors

T. Rungrotmongkol, Y. Shigeta, K. Choowongkomon, 2023, ACS omega.

Promising SARS-CoV-2 main protease inhibitor ligand-binding modes evaluated using LB-PaCS-MD/FMO

R. Harada, T. Rungrotmongkol, Y. Shigeta, 2022, Scientific Reports.

Solvophobicity-directed assembly of microporous molecular crystals

Y. Shigeta, Kohei Iwai, Hiroyasu Sato, 2021, Communications Chemistry.

A Practical Prediction of LogPo/w through Semiempirical Electronic Structure Calculations with Dielectric Continuum Model

Teruyuki Takahashi, Y. Shigeta, Toru Matsui, 2021, Bulletin of the Chemical Society of Japan.

Estimation of Acid Dissociation Constants (pKa) of N-Containing Heterocycles in DMSO and Transferability of Gibbs Free Energy in Different Solvent Conditions

Y. Shigeta, Toru Matsui, K. Hengphasatporn, 2020 .

In silico screening of chalcones and flavonoids as potential inhibitors against yellow head virus 3C-like protease

T. Rungrotmongkol, Y. Shigeta, P. Ounjai, 2023, PeerJ.

Agonist and Antagonist-Diverted Twisting Motions of a Single TRPV1 Channel.

Y. Shigeta, H. Sekiguchi, Y. Sasaki, 2020, The journal of physical chemistry. B.

Agonist and antagonist diverted twisting motions of single TRPV1 channel

Y. Shigeta, H. Sekiguchi, Y. Sasaki, 2020, bioRxiv.

X‐ray crystallographic and mutational analysis of the NylC precursor: catalytic mechanism of autocleavage and substrate hydrolysis of nylon hydrolase

Y. Higuchi, Y. Shigeta, D. Kato, 2023, The FEBS journal.

Interaction of 8-anilinonaphthalene-1-sulfonate with SARS-CoV-2 main protease and its application as a fluorescent probe for inhibitor identification

T. Rungrotmongkol, Y. Shigeta, Kowit Hengphasatporn, 2021, Computational and Structural Biotechnology Journal.

Identification of Promising Sulfonamide Chalcones as Inhibitors of SARS-CoV-2 3CLpro through Structure-Based Virtual Screening and Experimental Approaches.

T. Rungrotmongkol, Y. Shigeta, P. Wolschann, 2023, Journal of chemical information and modeling.

N-Containing α-Mangostin Analogs via Smiles Rearrangement as the Promising Cytotoxic, Antitrypanosomal, and SARS-CoV-2 Main Protease Inhibitory Agents

T. Rungrotmongkol, Y. Shigeta, S. Kamchonwongpaisan, 2023, Molecules.

Designing Potent α-Glucosidase Inhibitors: A Synthesis and QSAR Modeling Approach for Biscoumarin Derivatives

T. Rungrotmongkol, Y. Shigeta, Wanting Xie, 2023, ACS omega.

Structure—yeast α-glucosidase inhibitory activity relationship of 9-O-berberrubine carboxylates

T. Rungrotmongkol, W. Chavasiri, Siwaporn Boonyasuppayakorn, 2023, Scientific Reports.

A sulfonamide chalcone inhibited dengue virus with a potential target at the SAM-binding site of viral methyltransferase.

W. Chavasiri, Siwaporn Boonyasuppayakorn, Aphinya Suroengrit, 2023, Antiviral research.

Structural and thermodynamic insights into antibody light chain tetramer formation through 3D domain swapping

T. Uda, E. Hifumi, K. Hengphasatporn, 2023, Nature Communications.

FMO-guided design of darunavir analogs as HIV-1 protease inhibitors

T. Rungrotmongkol, V. Lee, S. Hannongbua, 2024, Scientific reports.

The 8-bromobaicalein alleviated chikungunya-induced musculoskeletal inflammation and reduced the viral load in healthy adult mice

W. Chavasiri, Siwaporn Boonyasuppayakorn, S. Wittayalertpanya, 2023, Emerging microbes & infections.