Publications

Selected Publications

  1. Keretsu, S., Hana, T., Lee, A., Kedei, N., Malik, N., Kim, H., … Terabe, M. (2025). Characterization of MAIT cells in glioblastoma reveals a potential immunosuppressive role through a MAIT–Neutrophil axis. Neuro-Oncology Advances, vdaf173. DOI
  2. Keretsu, S., & Sarmah, R. (2016). Weighted edge based clustering to identify protein complexes in protein–protein interaction networks incorporating gene expression profile. Computational Biology and Chemistry, 65, 69–79. DOI
  3. Keretsu, S., Bhujbal, S. P., & Cho, S. J. (2019). Computational study of paroxetine-like inhibitors reveals new molecular insight to inhibit GRK2 with selectivity over ROCK1. Scientific Reports, 9(1), 1–14. DOI
  4. Keretsu, S., Bhujbal, S. P., & Cho, S. J. (2019). Docking and 3D-QSAR studies of hydrazone and triazole derivatives for selective inhibition of GRK2 over ROCK2. Letters in Drug Design & Discovery, 17(5), 618–632. DOI
  5. Keretsu, S., Bhujbal, S. P., & Cho, S. J. (2020). Molecular modeling studies of pyrrolo[2,3-d]pyrimidin-4-amine derivatives as JAK1 inhibitors based on 3D-QSAR, molecular docking, molecular dynamics and MM-PBSA calculations. Journal of Biomolecular Structure and Dynamics, 1–13. DOI
  6. Keretsu, S., Bhujbal, S. P., & Cho, S. J. (2020). Rational approach toward COVID-19 main protease inhibitors via molecular docking, molecular dynamics simulation and free energy calculation. Scientific Reports, 10, 17716. DOI
  7. Keretsu, S., Ghosh, S., & Cho, S. J. (2020). Molecular modelling study of c-KIT/PDGFRα dual inhibitors for the treatment of gastrointestinal stromal tumors. International Journal of Molecular Sciences, 21(21), 8232. DOI

Other Publications

  1. Keretsu, S., & Sarmah, R. (2017). Identification of protein complexes in protein–protein interaction networks by core-attachment approach incorporating gene expression profile. International Journal of Bioinformatics Research and Applications, 13(4), 313–328. DOI
  2. Keretsu, S., Balasubramanian, P. K., Bhujbal, S. P., & Cho, S. J. (2017). Receptor-guided 3D-QSAR and docking studies of 6-substituted 2-arylaminopurines as CDK2 kinase inhibitors. Bulletin of the Korean Chemical Society, 38(11), 1275–1284. DOI
  3. Bhujbal, S. P., Keretsu, S., & Cho, S. J. (2019). Receptor-guided 3D-QSAR study of anilinoquinazolines as RET receptor tyrosine kinase antagonists. Bulletin of the Korean Chemical Society, 40(3), 207–213. DOI
  4. Bhujbal, S. P., Keretsu, S., & Cho, S. J. (2019). Macrocyclic effect on inhibitory activity: a modeling study on MerTK inhibitors. Medicinal Chemistry Research, 1–16. DOI
  5. Bhujbal, S. P., Keretsu, S., & Cho, S. J. (2019). A combined molecular docking and 3D-QSAR studies on tetrahydropteridin derivatives as PLK2 antagonists. Bulletin of the Korean Chemical Society, 40(8), 796–802. DOI
  6. Bhujbal, S. P., Keretsu, S., & Cho, S. J. (2019). Design of new therapeutic agents targeting FLT3 receptor tyrosine kinase using molecular docking and 3D-QSAR approach. Letters in Drug Design & Discovery, 17(5), 585–596. DOI
  7. Keretsu, S., Bhujbal, S. P., & Cho, S. J. (2020). Computational study of pyrimidin-2-aminopyrazol-hydroxamate based JAK2 inhibitors for the treatment of myeloproliferative neoplasms. Bulletin of the Korean Chemical Society, 41(5), 542–551. DOI
  8. Bhujbal, S. P., Keretsu, S., & Cho, S. J. (2019). Molecular modelling studies on pyrazole derivatives for the design of potent RET kinase inhibitors. Molecules. DOI