QSAR modeling approaches to identify a novel ACE2 inhibitor that selectively bind with the C and N terminals of the ectodomain-Reference-Cited by-同舟云学术

QSAR modeling approaches to identify a novel ACE2 inhibitor that selectively bind with the C and N terminals of the ectodomain

Published:2023-05-05 Issue: Volume: Page:1-20
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Jawarkar Rahul D.¹,Zaki Magdi E. A.²,Al-Hussain Sami A.²,Al-Mutairi Aamal A.²,Samad Abdul³,Mukerjee Nobendu⁴,Ghosh Arabinda⁵,Masand Vijay H.⁶,Ming Long Chiau⁷,Rashid Summya⁸

Affiliation:

1. Department of Medicinal Chemistry and Drug Discovery, Dr Rajendra Gode Institute of Pharmacy, Amravati, Maharashtra, India

2. Department of Chemistry, Faculty of Science, Imam Mohammad Ibn Saud Islamic University, Riyadh, Saudi Arabia

3. Department of Pharmaceutical Chemistry, Faculty of Pharmacy, Tishk International University, Erbil, Kurdistan Region, Iraq

4. Department of Microbiology, Ramakrishna Mission Vivekananda Centenary College, Kolkata, India

5. Microbiology Division, Department of Botany, Gauhati University, Guwahati, India

6. Department of Chemistry, Vidyabharati Mahavidyalalya, Amravati, Maharashtra, India

7. School of Medical and Life Sciences, Sunway University, Sunway City, Malaysia

8. Department of Pharmacology & Toxicology, College of Pharmacy, Prince Sattam Bin Abdulaziz University, Al-Kharj, Saudi Arabia

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2023.2205948

Reference86 articles.

1. Derivatives of the potent angiotensin converting enzyme inhibitor 5(S)-benzamido-4-oxo-6-phenylhexanoyl-L-proline: effect of changes at postions 2 and 5 of the hexanoic acid portion

2. The Renin-Angiotensin Aldosterone System: Pathophysiological Role and Pharmacologic Inhibition

3. Computer Aided Drug Design: Success and Limitations

4. Identification of potent aldose reductase inhibitors as antidiabetic (Anti-hyperglycemic) agents using QSAR based virtual Screening, molecular Docking, MD simulation and MMGBSA approaches

5. Roles of Angiotensin Peptides and Recombinant Human ACE2 in Heart Failure

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