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10.1038/s41598-020-67283-0

http://scihub22266oqcxt.onion/10.1038/s41598-020-67283-0
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suck abstract from ncbi


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pmid32576928      Sci+Rep 2020 ; 10 (1): 10187
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  • DREAM-in-CDM Approach and Identification of a New Generation of Anti-inflammatory Drugs Targeting mPGES-1 #MMPMID32576928
  • Zhou S; Zhou Z; Ding K; Yuan Y; Loftin C; Zheng F; Zhan CG
  • Sci Rep 2020[Jun]; 10 (1): 10187 PMID32576928show ga
  • Microsomal prostaglandin E2 synthase-1 (mPGES-1) is known as an ideal target for next generation of anti-inflammatory drugs without the side effects of currently available anti-inflammatory drugs. However, there has been no clinically promising mPGES-1 inhibitor identified through traditional drug discovery and development route. Here we report a new approach, called DREAM-in-CDM (Drug Repurposing Effort Applying Integrated Modeling-in vitro/vivo-Clinical Data Mining), to identify an FDA-approved drug suitable for use as an effective analgesic targeting mPGES-1. The DREAM-in-CDM approach consists of three steps: computational screening of FDA-approved drugs; in vitro and/or in vivo assays; and clinical data mining. By using the DREAM-in-CDM approach, lapatinib has been identified as a promising mPGES-1 inhibitor which may have significant anti-inflammatory effects to relieve various forms of pain and possibly treat various inflammation conditions involved in other inflammation-related diseases such as the lung inflammation caused by the newly identified COVID-19. We anticipate that the DREAM-in-CDM approach will be used to repurpose FDA-approved drugs for various new therapeutic indications associated with new targets.
  • |*Drug Repositioning[MESH]
  • |Anti-Inflammatory Agents/*pharmacology[MESH]
  • |Betacoronavirus[MESH]
  • |COVID-19[MESH]
  • |Computational Chemistry/methods[MESH]
  • |Coronavirus Infections/*drug therapy/pathology[MESH]
  • |Cyclooxygenase 1/metabolism[MESH]
  • |Cyclooxygenase 2/metabolism[MESH]
  • |Cyclooxygenase Inhibitors/pharmacology[MESH]
  • |Humans[MESH]
  • |Inflammation/drug therapy[MESH]
  • |Lapatinib/*pharmacology[MESH]
  • |Molecular Dynamics Simulation[MESH]
  • |Pandemics[MESH]
  • |Pneumonia, Viral/*drug therapy/pathology[MESH]
  • |Prostaglandin-E Synthases/*antagonists & inhibitors/metabolism[MESH]


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