Discovery of benzo[cd]indol-2-one and benzylidene-thiazolidine-2,4-dione as new classes of NLRP3 inflammasome inhibitors via ER-β structure based virtual screening.
Sign Up to like & getrecommendations! Published in 2019 at "Bioorganic chemistry"
DOI: 10.1016/j.bioorg.2019.103500
Abstract: The structure-guided virtual screening (VS) has proved to be successful strategy in identification of new scaffolds for biological targets. The overactivity of NLRP3 inflammasome has been implicated in variety of inflammatory diseases including Alzheimer's disease.… read more here.
Keywords: virtual screening; inflammasome inhibitors; inhibitors via; structure ... See more keywords
Piperazinobenzodiazepinones: New Encephalitic Alphavirus Inhibitors via Ring Expansion of 2-Dichloromethylquinazolinones
Sign Up to like & getrecommendations! Published in 2022 at "ACS Medicinal Chemistry Letters"
DOI: 10.1021/acsmedchemlett.1c00539
Abstract: Venezuelan and eastern equine encephalitis viruses are disease-causing, neuropathic pathogens with no approved treatment options in humans. While expanding the pharmacophoric model of antialphaviral amidines prepared via a quinazolinone rearrangement, we discovered that diamine-treated, 2-dihalomethylquinolinones… read more here.
Keywords: inhibitors via; alphavirus inhibitors; encephalitic alphavirus; piperazinobenzodiazepinones new ... See more keywords
Identification of potential benzoxazolinone as CYP1B1 inhibitors via molecular docking, dynamics, waterswap, and In vitro analysis
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DOI: 10.1039/d3nj01138k
Abstract: Overexpression of Cytochrome P450 1B1 in malignancies is accountable for the biotransformation-based inactivation of various chemotherapeutics such as docetaxel, paclitaxel, cisplatin, and tamoxifen. Additionally, it also plays a major role... read more here.
Keywords: inhibitors via; benzoxazolinone cyp1b1; identification potential; potential benzoxazolinone ... See more keywords
Concept of Viral Inhibitors via NTCP.
Sign Up to like & getrecommendations! Published in 2019 at "Seminars in liver disease"
DOI: 10.1055/s-0038-1676804
Abstract: Identification of sodium taurocholate cotransporting polypeptide (NTCP) as an entry receptor for hepatitis B and D viruses (HBV and HDV) has not only promoted our understanding of the mechanism underlying the viral entry process, but… read more here.
Keywords: viral inhibitors; inhibitors via; via ntcp; concept viral ... See more keywords