STRUCTURE BASED DOCKING STUDIES TOWARDS EXPLORING POTENTIAL ANGIOTENSIN-I RECEPTOR BLOCKERS OF SELECTED ALANGIUM SALVIFOLIUM PHYTOCHEMICALS AGAINST PROTECTIVE VASCULAR REMODELING.
Journal Title: International Journal of Advanced Research (IJAR) - Year 2018, Vol 6, Issue 5
Abstract
ACE is an important drug target in the treatment of vesicular diseses. ACE is primarily known for its ability to cleave Angiotensin -I to the vasoactive octa peptide Angiotensin-II, but is also able to cleave a number of other substrates including the vasodilator a physiological modulator of hematopoiesis. In present study virtual screening of Alangium salvifolium phytocompounds act as Angiotensin-I inhibitor and assess its molecular basis of inhibition. The present research computationally emphases to Angiotensin-I protein receptor with four Alangium phytocompounds, using molecular docking and simulation studies. From the results showed the interactions be?tween 4YAY (Angiotensin-I) receptor protein with A. salvifolium phytocompounds, a alangum1(Alangium-1(4(benzoyloxy)methyl-2hydroxyphenoxy tetrahydorxy hexoxone 1,2,3,4,5, pentaium ) showed the best glide docking XP score -8.5 kcal/mol binding energy value with best fit simulation study .. Based on the result, the Alangium-1 and target were run on MD simulations stable at 10 ns. Finally, this study concludes the Alangium-1 is a more suitable drug for vesicular remodeling by blocking Angiotensin signaling cascade.
Authors and Affiliations
Mohammad Nadeem Khan.
Keywords
Related Articles
- EP ID EP297000
- DOI 10.21474/IJAR01/7114
- Views 87
- Downloads 0
DEVELOPMENT OF A TURBINE SYSTEM TO EXTRACTION DEEP UNDERGROUNDWATER.
Due to the recent lack of rainfall, the undergroundwater level has dropped significantly, especially in the desert lands. Therefore, it is necessary to use multi-stage turbo pumps, but these pumps need high power to be u...
SIMULTANEOUS REPAIR OF BILATERAL INGUINAL HERNIA BY LICHTENSTEIN REPAIR.
Background: Several approaches have been used for repair of groin hernias, each repair has its advantage and disadvantage, this Study presents a comparison between both techniques Stoppa versus bilateral Lichtenstein for...
A STUDY ON VARIOUS INNOVATIVE PRACTICES INCORPORATED BY THE FRONT OFFICE DEPARTMENT & MEASURING THEIR IMPACT ON GUEST SATISFACTION WITH RESPECT TO THE WESTIN GURGAON, NEW DELHI HOTEL.
The research paper focuses on finding the various innovative practices incorporated by the front office department of The Westin Gurgaon, New Delhi hotel and measuring their impact on guest satisfaction comprehensively....
EFFECT OF SWIMMING AS A HYDROTHERAPEUTIC INTERVENTION FOR THE MANAGEMENT OF CHRONIC NON-SPECIFIC LOW BACK PAIN - AN EXPERIMENTAL STUDY.
Objective: to evaluate the effect of swimming, as a hydrotherapeutic intervention, in subjects with chronic non specific low back pain, in reducing pain, improving range of motion and function within a period of four wee...
ROLE OF RASAYANA DRAVYA AND DIET AS PREVENTIVE MEDICINE IN VYADHI OF MAHASROTASA WITH SPECIAL REFERENCE TO GASTROINTESTINAL TRACT DISORDER: A CONCEPTUAL STUDY.
The aim of Ayurved is not only for treat the disease but also prevent it. Two types of treatment modalities are explained, one is SvasthasyaUrjaskara, in which drugs are given to prevent the disease, another is ArtasyaRo...