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Journal of Receptors and Signal Transduction Volume 32, 2012 - Issue 2
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Research Article

Pharmacophore mapping and in silico screening to identify new potent leads for A2A adenosine receptor as antagonists

Kiran Kumar MustyalaDepartment of Chemistry, Nizam College, Osmania University, Basheerbagh, Hyderabad, Andhra Pradesh, India
,
Annapurna Renee ChitturiDepartment of Pharmacy, University College of Technology, Osmania University, Hyderabad, Andhra Pradesh, India
,
Prameela Subhashini Naikal JamesDepartment of Pharmacy, University College of Technology, Osmania University, Hyderabad, Andhra Pradesh, India
&
Uma VuruputuriDepartment of Chemistry, Nizam College, Osmania University, Basheerbagh, Hyderabad, Andhra Pradesh, IndiaCorrespondence[email protected] [email protected]
Pages 102-113 | Received 07 Oct 2011, Accepted 13 Dec 2011, Published online: 02 Mar 2012

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Read on this site (3)

Vasavi Malkhed, Kiran Kumar Mustyala, Sarita Rajender Potlapally & Uma Vuruputuri. (2014) Identification of novel leads applying in silico studies for Mycobacterium multidrug resistant (MMR) protein. Journal of Biomolecular Structure and Dynamics 32:12, pages 1889-1906.
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Kiran Kumar Mustyala, Vasavi Malkhed, Sarita Rajender Potlapally, Venkataramana Reddy Chittireddy & Uma Vuruputuri. (2014) Macromolecular structure and interaction studies of SigF and Usfx in Mycobacterium tuberculosis. Journal of Receptors and Signal Transduction 34:3, pages 162-173.
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Palani Kirubakaran & Muthusamy Karthikeyan. (2013) Pharmacophore modeling, 3D-QSAR and DFT studies of IWR small-molecule inhibitors of Wnt response. Journal of Receptors and Signal Transduction 33:5, pages 276-285.
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Articles from other publishers (6)

Omar H.A. Al-Attraqchi, Mahesh Attimarad, Katharigatta N. Venugopala, Anroop Nair & Noor H.A. Al-Attraqchi. (2019) Adenosine A2A Receptor as a Potential Drug Target - Current Status and Future Perspectives. Current Pharmaceutical Design 25:25, pages 2716-2740.
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Fan Fan, Dora Toledo Warshaviak, Hisham K. Hamadeh & Robert T. Dunn. (2019) The integration of pharmacophore-based 3D QSAR modeling and virtual screening in safety profiling: A case study to identify antagonistic activities against adenosine receptor, A2A, using 1,897 known drugs. PLOS ONE 14:1, pages e0204378.
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Saikiran Reddy Peddi, Sree Kanth Sivan & Vijjulatha Manga. (2018) Discovery and design of new PI3K inhibitors through pharmacophore-based virtual screening, molecular docking, and binding free energy analysis. Structural Chemistry 29:6, pages 1753-1766.
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Agostinho Lemos, Rita Melo, Irina S. Moreira & M. Natália D. S. Cordeiro. 2018. Computational Modeling of Drugs Against Alzheimer’s Disease. Computational Modeling of Drugs Against Alzheimer’s Disease 61 106 .
Rohini Rondla, Lavanya Souda Padma Rao, Vishwanath Ramatenki, Rajender Vadija, Thirupathi Mukkera, Sarita Rajender Potlapally & Uma Vuruputuri. (2017) Azolium analogues as CDK4 inhibitors: Pharmacophore modeling, 3D QSAR study and new lead drug discovery. Journal of Molecular Structure 1134, pages 482-491.
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Lihui Zhang, Tianjun Liu, Xia Wang, Jinan Wang, Guohui Li, Yan Li, Ling Yang & Yonghua Wang. (2014) Insight into the binding mode and the structural features of the pyrimidine derivatives as human A2A adenosine receptor antagonists. Biosystems 115, pages 13-22.
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