Discovering Gummadiol and Isoarboreol as potential inhibitors of sphingosine kinase 1: virtual screening and MD simulation studies-Reference-Cited by-同舟云学术

Discovering Gummadiol and Isoarboreol as potential inhibitors of sphingosine kinase 1: virtual screening and MD simulation studies

Published:2023-01-16 Issue: Volume: Page:1-9
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Elasbali Abdelbaset Mohamed¹,Al-Soud Waleed Abu²,Alhassan Hassan H.²,Mousa Elayyan Afnan Elayyan¹,Kamal Mehnaz³,Alanazi Hamad¹,Alharbi Bandar⁴,Alharethi Salem Hussain⁵,Mohamed Bashir M.⁶⁷⁸⁹

Affiliation:

1. Department of Clinical Laboratory Science, College of Applied Sciences-Qurayyat, Jouf University, Sakaka, Saudi Arabia

2. Department of Clinical Laboratory Science, College of Applied Sciences, Jouf University, Sakaka, Saudi Arabia

3. Department of Pharmaceutical Chemistry, College of Pharmacy, Prince Sattam Bin Abdulaziz University, Saudi Arabia

4. Department of Medical Laboratory Science, College of Applied Medical Sciences, University of Ha’il, Hail, Saudi Arabia

5. Department of Biological Science, College of Arts and Science, Najran University, Najran, Saudi Arabia

6. Trinity St James’s Cancer Institute, Dublin, Ireland

7. Department of Histopathology, Trinity College Dublin, Ireland

8. Emer Casey Molecular Pathology Research Laboratory, Coombe Women & Infants University Hospital, Dublin, Ireland

9. Department of Obstetrics and Gynaecology, Trinity College Dublin, Dublin, Ireland

Funder

Jouf University

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2023.2167864

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4. Discovery of Natural Compounds as Potential Inhibitors of Human Carbonic Anhydrase II: An Integrated Virtual Screening, Docking, and Molecular Dynamics Simulation Study

5. Phytoconstituents and Medicinal Plants for Anticancer Drug Discovery: Computational Identification of Potent Inhibitors of PIM1 Kinase