Articles with "docking novel" as a keyword



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Synthesis and Docking of Novel 3‐Indolylpropyl Derivatives as New Polypharmacological Agents Displaying Affinity for 5‐HT1AR/SERT

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Published in 2017 at "Archiv der Pharmazie"

DOI: 10.1002/ardp.201600271

Abstract: A series of novel 3‐indolylpropyl derivatives was synthesized and evaluated for their binding affinities at the serotonin‐1A receptor subtype (5‐HT1AR) and the 5‐HT transporter (SERT). Compounds 11b and 14b exhibited the highest affinities at the… read more here.

Keywords: ht1ar; synthesis docking; indolylpropyl derivatives; novel indolylpropyl ... See more keywords
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Synthesis, biological evaluation, and molecular docking of novel hydroxyzine derivatives as potential AR antagonists

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Published in 2022 at "Frontiers in Chemistry"

DOI: 10.3389/fchem.2022.1053675

Abstract: Prostate cancer (PCa) is a malignant tumor with a higher mortality rate in the male reproductive system. In this study, the hydroxyazine derivatives were synthesized with different structure from traditional anti-prostate cancer drugs. In the… read more here.

Keywords: molecular docking; synthesis biological; docking novel; prostate cancer ... See more keywords
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Inverse Molecular Docking as a Novel Approach to Study Anticarcinogenic and Anti-Neuroinflammatory Effects of Curcumin

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Published in 2018 at "Molecules"

DOI: 10.3390/molecules23123351

Abstract: Research efforts are placing an ever increasing emphasis on identifying signal transduction pathways related to the chemopreventive activity of curcumin. Its anticarcinogenic effects are presumably mediated by the regulation of signaling cascades, including nuclear factor… read more here.

Keywords: protein; inverse molecular; receptor; factor ... See more keywords