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PATIL LAB
Publications
DiFrancesco M., Hofer J., Aradhya A., Rufinus J., Stoddart J., Finocchiaro S., Mani J., Tevis S., Visconti M., Walawender G., DiFlumeri J., Fattakhova E., Patil S.P. “Discovery of small-molecule PD-1/PD-L1 antagonists through combined virtual screening and experimental validation", Computational Biology and Chemistry, 102: 107804 (2023). Pubmed Abstract
Patil S.P., DiFlumeri J., Wellington J., Fattakhova E., Oravic M. “Alzheimer’s neuroinflammation: A crosstalk between immune checkpoint PD1-PDL1 and ApoE-Heparin interactions?", Medical Hypotheses, 164: 110865 (2022). Paper Weblink
Patil S.P., Fattakhova E., Hofer J., Oravic M., Bender A., Brearey J., Parker D., Radnoff M., Smith Z. “Machine-Learning Guided Discovery of Bioactive Inhibitors of PD1-PDL1 Interaction", Pharmaceuticals, 15 (5): 613 (2022). Pubmed Abstract
Patil S.P., Hofer J., Ballester P.J., Fattakhova E., DiFlumeri J., Campbell A., Oravic M. “Drug repurposing for covid-19: discovery of potential small-molecule inhibitors of spike protein-ACE2 receptor interaction through virtual screening and consensus scoring", ChemRxiv, (2020). Paper Weblink
Highlighted Paper selected by Editor-in-Chief:
Patil S.P., Yoon S.-C., Aradhya A.G., Hofer J., Fink M.A., Enley E.S., Fisher J.E., Herb M.C., Klingos A., Proulx J.T., Fedorky M.T. “Macrocyclic Compounds from Ansamycin Antibiotic Class as Inhibitors of PD1-PDL1 Protein-Protein Interaction", Chemical and Pharmaceutical Bulletin, 66: 773-778 (2018). Pubmed Abstract
Patil, S. P., Kerezsi, C. R., Hicks, B. M., Jednorski, A. H. “Molecular modeling investigation of folic acid conjugation to MDM2 inhibitors for enhanced cellular uptake and target binding", Current Computer-Aided Drug Design, 11: 258-265 (2015). Pubmed Abstract
Patil, S. P., Pacitti, M. F., Gilroy, K. S., Ruggiero, J. C., Griffin, J. D., Stoddart, J. W. “Identification of antipsychotic drug fluspirilene as a potential p53-MDM2 Inhibitor: A combined computational and experimental study”, Journal of Computer-Aided Molecular Design, 29(2):155-163 (2015). Pubmed Abstract
Patil, S. P., Ballester, P. J., Kerezsi, C., “Prospective virtual screening for novel p53-MDM2 inhibitors using Ultrafast Shape Recognition”, Journal of Computer-Aided Molecular Design, 28: 89-97 (2014). Pubmed Abstract
Patil, S. P., “FOLICation: Engineering approved drugs as p53-MDM2 interaction inhibitors for cancer therapy”, Medical Hypotheses, 81: 1104-1107 (2013). Pubmed Abstract
Patil, S. P., Nhung, T., Geekiyanage, H., Liu, Li and Chan, C., “Curcumin-induced upregulation of the anti-tau cochaperone BAG2 in primary rat cortical neurons”, Neuroscience Letters, 554: 121-125 (2013). Pubmed Abstract
Patil, S. P., Ballard, R., Sanchez, S., Osborn, J. and Santangelo, D., “ApoE: The link between Alzheimer’s-related glucose hypometabolism and Aβ deposition?” Medical Hypotheses, 78: 494-496 (2012). Pubmed Abstract
Patil, S. P., Maki, S., Khedkar, S. A., Rigby, A. C. and Chan, C., “Withanolide A and Asiatic Acid Modulate Multiple Targets Associated with Amyloid-β Precursor Protein Processing and Amyloid-β Protein Clearance”, Journal of Natural Products, 73: 1196-1202 (2010). Pubmed Abstract
Patil, S. P., Balu, D., Melrose, J. and Chan, C., “Brain region-specificity of palmitic acid-induced Alzheimer-like changes in primary neurons”, BMC Research Notes, 1: 20 (2008). BMC Abstract
Patil, S. P., Melrose, J. and Chan, C., “Involvement of astroglial ceramide in palmitic acid-induced Alzheimer-like changes in primary neurons”, European Journal of Neuroscience, 26: 2131-2141 (2007). Pubmed Abstract
Patil, S. P., Lufang, S., Masserang, A. and Chan, C., “Palmitic acid-treated astrocytes induce BACE1 upregulation and accumulation of C-terminal fragment of APP in primary cortical neurons”, Neuroscience Letters, 406: 55-59 (2006). Pubmed Abstract
Patil, S. P., Li, Z. and Chan, C., “Cellular to Tissue Informatics: Approaches to Optimizing Cellular Function of Engineered Tissue", Advances in Biochemical Engineering / Biotechnology, eds. K. Lee and D. Kaplan, 102: 139-159 (2006). Pubmed Abstract
Patil, S. P. and Chan, C., “Palmitic and Stearic fatty acids induce Alzheimer-like hyperphosphorylation of tau in primary rat cortical neurons”, Neuroscience Letters, 384: 288-293 (2005). Pubmed Abstract
Patil, S. P. and Yadav, G. D., “Selective acylation of 2 methoxynaphthalene by large pore zeolites: catalyst selection through molecular modeling”, Computational Biology and Chemistry, 27: 393-404 (2003). Pubmed Abstract
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