Table of Contents Author Guidelines Submit a Manuscript
BioMed Research International
Volume 2017, Article ID 2105610, 17 pages
https://doi.org/10.1155/2017/2105610
Research Article

Sulfonanilide Derivatives in Identifying Novel Aromatase Inhibitors by Applying Docking, Virtual Screening, and MD Simulations Studies

1Division of Applied Life Science (BK21 Plus), Plant Molecular Biology and Biotechnology Research Center (PMBBRC), Systems and Synthetic Agrobiotech Center (SSAC), Research Institute of Natural Science (RINS), Gyeongsang National University (GNU), 501 Jinju-daero, Jinju 52828, Republic of Korea
2Division of Quality of Life, Korea Research Institute of Standards and Science, Daejeon 34113, Republic of Korea
3Bio-Computing Major, Korean German Institute of Technology, Seoul 07582, Republic of Korea

Correspondence should be addressed to Keun Woo Lee; rk.ca.ung@eelwk

Received 11 May 2017; Revised 31 July 2017; Accepted 27 August 2017; Published 17 October 2017

Academic Editor: Mai S. Li

Copyright © 2017 Shailima Rampogu et al. This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

Citations to this Article [9 citations]

The following is the list of published articles that have cited the current article.

  • S. Rampogu, C. Park, M. Son, A. Baek, A. Zeb, G. Lee, and K.W. Lee, “Modulation of aromatase by natural compounds—A pharmacophore guided molecular modelling simulations,” South African Journal of Botany, 2018. View at Publisher · View at Google Scholar
  • Shailima Rampogu, Saravanan Parameswaran, Mary Rampogu Lemuel, and Keun Woo Lee, “Exploring the Therapeutic Ability of Fenugreek against Type 2 Diabetes and Breast Cancer Employing Molecular Docking and Molecular Dynamics Simulations,” Evidence-Based Complementary and Alternative Medicine, vol. 2018, pp. 1–12, 2018. View at Publisher · View at Google Scholar
  • Shailima Rampogu, Minky Son, Ayoung Baek, Chanin Park, Rabia Mukthar Rana, Amir Zeb, Saravanan Parameswaran, and Keun Woo Lee, “Targeting natural compounds against HER2 kinase domain as potential anticancer drugs applying pharmacophore based molecular modelling approaches,” Computational Biology and Chemistry, 2018. View at Publisher · View at Google Scholar
  • Rajesh Goud Gajula, Keun Woo Lee, Amir Zeb, Yongseong Kim, Shailima Rampogu, Rohit S. Bavi, Yong Jung Kwon, Ayoung Baek, and Raj Kumar, “Ginger (Zingiber officinale) phytochemicals-gingerenone-A and shogaol inhibit SaHPPK: Molecular docking, molecular dynamics simulations and in vitro approaches,” Annals of Clinical Microbiology and Antimicrobials, vol. 17, no. 1, 2018. View at Publisher · View at Google Scholar
  • Shailima Rampogu, Ayoung Baek, Keun Woo Lee, and Amir Zeb, “Exploration for novel inhibitors showing back-to-front approach against VEGFR-2 kinase domain (4AG8) employing molecular docking mechanism and molecular dynamics simulations,” BMC Cancer, vol. 18, no. 1, 2018. View at Publisher · View at Google Scholar
  • Shailima Rampogu, Amir Zeb, Ayoung Baek, Chanin Park, Minky Son, and Keun Woo Lee, “Discovery of Potential Plant-Derived Peptide Deformylase (PDF) Inhibitors for Multidrug-Resistant Bacteria Using Computational Studies,” Journal of Clinical Medicine, vol. 7, no. 12, pp. 563, 2018. View at Publisher · View at Google Scholar
  • Jacopo Sgrignani, Lorenzo Casalino, Fabio Doro, Angelo Spinello, and Alessandra Magistrato, “Can multiscale simulations unravel the function of metallo-enzymes to improve knowledge-based drug discovery?,” Future Medicinal Chemistry, 2019. View at Publisher · View at Google Scholar
  • Shailima Rampogu, Chanin Park, Doneti Ravinder, Minky Son, Ayoung Baek, Amir Zeb, Rohit Bavi, Raj Kumar, Gihwan Lee, Shraddha Parate, Smita C. Pawar, Yohan Park, Seok Ju Park, and Keun Woo Lee, “Pharmacotherapeutics and Molecular Mechanism of Phytochemicals in Alleviating Hormone-Responsive Breast Cancer,” Oxidative Medicine and Cellular Longevity, vol. 2019, pp. 1–14, 2019. View at Publisher · View at Google Scholar
  • Angelo Spinello, Silvia Martini, Federico Berti, Marzia Pennati, Matic Pavlin, Jacopo Sgrignani, Giovanni Grazioso, Giorgio Colombo, Nadia Zaffaroni, and Alessandra Magistrato, “Rational design of allosteric modulators of the aromatase enzyme: An unprecedented therapeutic strategy to fight breast cancer,” European Journal of Medicinal Chemistry, 2019. View at Publisher · View at Google Scholar