Author(s): Suraj Kumar A. Kakade, Sachin H. Rohane

Email(s): surajkumarkakade2018@gmail.com

DOI: 10.52711/2231-5713.2023.00045   

Address: Suraj Kumar A. Kakade*, Sachin H. Rohane
Department of Pharmacy at Yashoda Technical Capmus, Satara.
*Corresponding Author

Published In:   Volume - 13,      Issue - 4,     Year - 2023


ABSTRACT:
Molecular Docking has become an important component of the drug discovery process. Since first being developed in the 1980s, advancements in the power of computer hardware and the increasing number of and ease of access to small molecule and protein structures have contributed to the development of improved methods, making docking more popular in both industrial and academic settings. In this research Molecular Docking we are perform on triamcinolone and methyl testosterone by using Autodock and Discovery Studio software. QSAR study revealsed that substitution of different electron donating or withdrawing group at different position on triamcinolone and methyl testosterone lead nucleus elaborate change in pharmacological activity. Molecular Docking done by substituting or replacing different group at different position affected the potency of drug on addition of hydroxy, Methyl at different position where reduced the potency of triamcinolone while addition of ether or ester group enhance the potency of triamcinolone. In methyl testosterone, introduction of heterocyclic system into a steroidal nucleus in ring A enhances the potency while removal of hydroxy group, addition of O atom reduces the potency.


Cite this article:
Suraj Kumar A. Kakade, Sachin H. Rohane. In Silico Study of Corticosteroids Drugs. Asian Journal of Pharmacy and Technology. 2023; 13(4):250-6. doi: 10.52711/2231-5713.2023.00045

Cite(Electronic):
Suraj Kumar A. Kakade, Sachin H. Rohane. In Silico Study of Corticosteroids Drugs. Asian Journal of Pharmacy and Technology. 2023; 13(4):250-6. doi: 10.52711/2231-5713.2023.00045   Available on: https://ajptonline.com/AbstractView.aspx?PID=2023-13-4-3


REFERENCES:
1.    3D-QSAR analysis of some HIV Reserve Transcriptase Inhibitors. 2011; 4(9):1385-1387.
2.    Dwivedi SD, Bharadwaj A, Shrivastava A. Application of Topological Descriptor: QSAR Study of Chalcone Derivatives. Asian J Res Chem. 2010; 3(4):1030-1034.
3.    2. Parimal M Prajapati, Yatri Shah, DJ Sen CP. Combinatorial Chemistry: A New Approch for Drug Discovery. Asian J Res Chem. 2010; 3(2):249-254.
4.    Otuokere IE, Amaku FJ. Computer-aided drug design of an anti-angiogenic and immunomodulatory agent, -(2,4-dioxocyclohexyl)-1 H -isoindole-1,3(2 H )-dione (thalidomide). Asian J Res Chem. 2015; 8(9):601. doi:10.5958/0974-4150.2015.00095.4
5.    Valluri KK, Allaka TR, Viswanath IVK, Nagaraju P. Design, molecular docking studies of oxaprozin linked to 4-Thiazolidinone derivatives as a potent anticancer, analgesic and antiinflammatory agents. Asian J Res Chem. 2018; 11(3):617. doi:10.5958/0974-4150.2018.00111.6
6.    Manojkumar R. Patle SHG. In-Silico Inhibition Studies of Phenothiazine Based Compounds on Quinolinic Acid Phosphoribosyltransferase (1QPQ) Enzyme as A Potent Anti-Tuberculosis Agent. Asian J Res Chem. 2011; 4(6):990-996.
7.    Rajendraprasad Y, Raju M, Rajasekhar K, Sowjanya S. Insilico Prodrug Designing of Some Matrix Metallo Proteinase Inhibitors Derived From Tanomastat. Asian J Res Chem. 2010; 3(2):411-415.
8.    Meena Chandran, Shiny George, Kumaran Santhalingam, Pallavi Gangwar RD. 4 h -Chromen-4-One Derivatives Against Il-6 for Rheumatoid Arthritis. Asian J Res Chem. 2011; 4(8):1254-1257.
9.    Dhananjayan K, Sumathy A, Palanisamy S. Molecular Docking Studies and in-vitro Acetylcholinesterase Inhibition by Terpenoids and Flavonoids. Asian J Res Chem. 2013; 6(11):1011-1017. www.ajrconline.org
10.    Faldu PR, Dadhaniya SK, J Patel C, Vidyasagar G. Multi-Component Reaction and Their Application in Drug Discovery. Asian J Res Chem. 2011; 4(12):1818-1824.
11.    Nangare SA, Rohane SH. Review on Guassion, the General Purpose in Computational Chemistry for Medicinal Chemistry. Asian J Res Chem. 2021; 14(1):1-3. doi:10.5958/0974-4150.2021.00015.8
12.    Satpute UM, Rohane SH. Efficiency of AUTODOCK: Insilico study of Pharmaceutical Drug Molecules. Asian J Res Chem. 2021; 14(1):1-5. doi:10.5958/0974-4150.2021.00016.x
13.    Galande AK, Rohane SH. Insilico Molecular docking analysis in Maestro Software. Asian J Res Chem. 2021; 14(1):1-4. doi:10.5958/0974-4150.2021.00017.1
14.    Pawar SS, Rohane SH. Review on Discovery Studio: An important Tool for Molecular Docking. Asian J Res Chem. 2021; 14(1):1-3. doi:10.5958/0974-4150.2021.00014.6
15.    Pawar RP, Rohane SH. Role of Autodock vina in PyRx Molecular Docking. Asian J Res Chem. 2021; 14(2):132-134. doi:10.5958/0974-4150.2021.00024.9
16.    Jejurikar BL, Rohane SH. Drug Designing in Discovery Studio. Asian J Res Chem. 2021; 14(2):135-138. doi:10.5958/0974-4150.2021.00025.0
17.    Patil NS, Rohane SH. Organization of Swiss Dock: In study of Computational and Molecular Docking Study. Asian J Res Chem. 2021; 14(2):145-148. doi:10.5958/0974-4150.2021.00027.4
18.    Aware D, Rohane S. A Role of Herbal Drug as an Immunity Booster during Covid-19 Pandemic. Asian J Pharm Res. 2021; 11(3):206-211. doi:10.52711/2231-5691.2021.00037
19.    Bagal A, Borkar T, Ghige T, et al. Molecular Docking – Useful Tool in Drug Discovery. Asian J Res Chem. 2022; 15(April):129-132. doi:10.52711/0974-4150.2022.00020
20.    Bireche K, Dendougui H, Abid A, Messaoudi A, Hadjadj M. Pulicaria laciniata (Coss and Kral): Effects of Different Extraction Solvents on Phytochemical Screening and Antioxidant Activity. Asian J Res Chem. 2021; 14(December):425-430. doi:10.52711/0974-4150.2021.00073
21.    Yadav T, Rohane S. Acute Toxicity study of Synthesized drug and Herbal Product. Asian J Pharm Res. 2021; 11(4):251-256. doi:10.52711/2231-5691.2021.00044

Recomonded Articles:

Author(s): Hafsa, Asfa, Nuha Rasheed, Abdul Saleem Mohammad

DOI: 10.5958/2231-5713.2017.00001.0         Access: Open Access Read More

Author(s): Amit Roy, Pushpa Prasad, Nirmala Gupta

DOI:         Access: Open Access Read More

Author(s): Shweta Gautam, Priya Singh, Yogesh Shivhare

DOI:         Access: Open Access Read More

Author(s): Yogita. Chowdhary

DOI: 10.5958/2231-5713.2018.00002.8         Access: Open Access Read More

Author(s): Kruti M. Patel, Pratik R. Patel

DOI: 10.5958/2231-5713.2017.00036.8         Access: Open Access Read More

Author(s): Sindhu. T. J, Arathi. K. N, Akhilesh K. J, Anju. Jose, Binsiya K. P, Blessy Thomas, Elizabeth Wilson

DOI: 10.5958/2231-5713.2020.00012.4         Access: Open Access Read More

Author(s): Sanjay Kshirsagar, Manisha Choudhari, Reshmi Sathyan, Shruti Dhore

DOI: 10.5958/2231-5713.2019.00024.2         Access: Open Access Read More

Author(s): Debarshi Kar Mahapatra , Ruchi S. Shivhare , Vinod G. Ugale

DOI: 10.5958/2231-5713.2018.00008.9         Access: Open Access Read More

Author(s): Jaya Preethi P., Karthikeyan E., Lohita M., Goutham Teja P., Subhash M., Shaheena P., Prashanth Y., Sai Nandhu K.

DOI: 10.5958/2231-5713.2015.00021.5         Access: Open Access Read More

Author(s): Punasiya Rakesh, Pillai Sujit, Yadav Janeshwer

DOI: 10.5958/2231-5713.2015.00002.1         Access: Open Access Read More

Author(s): Selvakumar K., Madhan R., Srinivasan G. , Baskar V.

DOI:         Access: Open Access Read More

Author(s): S. Rawat, Akhilesh Gupta

DOI:         Access: Open Access Read More

Author(s): Prajapati Krishna V., Jain Vinit C., Prajapati Neelam

DOI: 10.5958/2231-5713.2016.00007.6         Access: Open Access Read More

Author(s): Goli Venkateshwarlu, Ragya Eslavath, Anasuri Santhosh, Gutha Suma, J.Venkanna, Y.Swetha

DOI:         Access: Open Access Read More

Author(s): Dibyajyoti Saha, Swati Paul

DOI:         Access: Open Access Read More

Author(s): Shamali Dange, Ravindra Jadhav, Sunayana Vikhe

DOI: 10.52711/2231-5713.2022.00004         Access: Closed Access Read More

Author(s): Anita S. Godase, Nayana V. Pimpodkar, Yogita R. Indalkar

DOI: 10.5958/2231-5713.2015.00030.6         Access: Open Access Read More

Asian Journal of Pharmacy and Technology (AJPTech.) is an international, peer-reviewed journal, devoted to pharmaceutical sciences...... Read more >>>

RNI: Not Available                     
DOI: 10.5958/2231–5713 


Recent Articles




Tags