Molecular modeling of novel 2-aminopyridine derivatives as potential JAK2 inhibitors: a rational strategy for promising anticancer agents-Reference-Cited by-同舟云学术

Molecular modeling of novel 2-aminopyridine derivatives as potential JAK2 inhibitors: a rational strategy for promising anticancer agents

Published:2024-03-06 Issue: Volume: Page:1-16
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Munir Nadia¹,Chohan Tahir Ali¹,Qayyum Aisha²,Chohan Talha Ali³,Batool Fakhra⁴,Mustafa Mian Waqar⁵,Anwar Sirajudheen⁶,Alheibshy Fawaz⁷⁸,Hussein Weiam⁹¹⁰,Alafnan Ahmed⁶,Khurshid Umair¹¹,Khursheed Anjum¹²,Saleem Hammad¹

Affiliation:

1. Institute of Pharmaceutical Sciences (IPS), University of Veterinary and Animal Sciences (UVAS), Lahore, Pakistan

2. Department of Pediatric Medicine, Fatima Memorial Hospital, Lahore, Pakistan

3. Institute of Molecular Biology and Biotechnology, The University of Lahore, Lahore, Pakistan

4. Department of Pharmacy, The Women University Multan, Multan, Pakistan

5. Department of Pharmacy, Forman Christian College University, Lahore, Pakistan

6. Department of Pharmacology and Toxicology, College of Pharmacy, University of Ha’il, Hail, Saudi Arabia

7. Department of Pharmaceutics, College of Pharmacy, University of Ha’il, Hail, Saudi Arabia

8. Department of Pharmaceutics, Faculty of Pharmacy, Aden University, Aden, Yemen

9. Department of Pharmaceutical Chemistry, College of Pharmacy, University of Ha’il, Hail, Saudi Arabia

10. Department of Pharmaceutical Chemistry, Faculty of Pharmacy, Aden University, Aden, Yemen

11. Department of Pharmaceutical Chemistry, Faculty of Pharmacy, The Islamia University of Bahawalpur, Bahawalpur, Pakistan

12. Faculty of Pharmacy, Grand Asian University Sialkot, Sialkot, Pakistan

Publisher

Informa UK Limited

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2024.2324345

Reference21 articles.

1. Pyrazinamide resistance of novel mutations in pncA and their dynamic behavior

2. Making it Rain: Cloud-Based Molecular Simulations for Everyone

3. Role of JAK2/STAT3 Signaling Pathway in the Tumorigenesis, Chemotherapy Resistance, and Treatment of Solid Tumors: A Systemic Review

4. Understanding the structural features of JAK2 inhibitors: a combined 3D-QSAR, DFT and molecular dynamics study

5. 3D-QSAR, docking, molecular dynamics simulation and free energy calculation studies of some pyrimidine derivatives as novel JAK3 inhibitors