Matches in SemOpenAlex for { <https://semopenalex.org/work/W4311544022> ?p ?o ?g. }
- W4311544022 endingPage "100721" @default.
- W4311544022 startingPage "100721" @default.
- W4311544022 abstract "Candida albicans is a polymorphic human microflora species, which caused a candidiasis. This disease frequently occurred in immunocompromised patients with considerable medical outcomes due to the damage from its infections. Secreted Aspartic Proteinase (SAP) 4–6 regulated the virulence of C. albicans. Thus, inhibiting those protenases may useful to obtain a better prognosis. On the other hand, Cinnamomum zeylanicum reported to have anti-cadidiasis. However, the mechanism of action on the anti-cadidiasis activity remains unclear. This study will explain the possible mechanism of anti-candidiasis from the bioactives of C. zeylanicum through SAP 4–6 inhibion. A computational analysis was employed by molecular docking coupled with molecular dynamics simulation to comprehend the interaction among C. zeylanicum bioactives to SAP 4–6. Positive docking outcomes were observed, with Cinnamaldehyde, Pyrantel Hydrochloride, and Hexadecenoic Acidbecame showed promising binding affinity against SAP 4–6. However, those compounds interacted with different residues of each proteinase. Only Hexadenoic Acid bound to the catalytic residues of SAP5-6. Molecular dynamics simulated the stable binding of Hexadecenoid Acid to the SAP5-6. Not only has stable structural integrity, the binding of Hexadecenoic Acidalso showed minimum alterations on the structural stability of SAP5-6, which suggested a stable inhibitory activity. The stable binding of Hexadecenoid Acid also displayed by the prominent number of hydrogen bond and the free-binding energy simulations. In conclusion, the anti-candidiasis activity of C. zeylanicum may take place in the SAP5-6 inhibition, mainly by Hexadecenoic Acid." @default.
- W4311544022 created "2022-12-27" @default.
- W4311544022 creator A5029653950 @default.
- W4311544022 creator A5063405665 @default.
- W4311544022 creator A5067466595 @default.
- W4311544022 creator A5071611751 @default.
- W4311544022 creator A5072860904 @default.
- W4311544022 creator A5075087471 @default.
- W4311544022 date "2023-01-01" @default.
- W4311544022 modified "2023-10-17" @default.
- W4311544022 title "Molecular docking analysis of Cinnamomum zeylanicum phytochemicals against Secreted Aspartyl Proteinase 4–6 of Candida albicans as anti-candidiasis oral" @default.
- W4311544022 cites W1195617583 @default.
- W4311544022 cites W1664015409 @default.
- W4311544022 cites W1730730449 @default.
- W4311544022 cites W1887624773 @default.
- W4311544022 cites W1921022470 @default.
- W4311544022 cites W1963514652 @default.
- W4311544022 cites W1968984443 @default.
- W4311544022 cites W1978296879 @default.
- W4311544022 cites W1980705831 @default.
- W4311544022 cites W2001640596 @default.
- W4311544022 cites W2011310234 @default.
- W4311544022 cites W2045895835 @default.
- W4311544022 cites W2049978018 @default.
- W4311544022 cites W2057572370 @default.
- W4311544022 cites W2080877667 @default.
- W4311544022 cites W2084021973 @default.
- W4311544022 cites W2086998856 @default.
- W4311544022 cites W2101010261 @default.
- W4311544022 cites W2127077017 @default.
- W4311544022 cites W2137959581 @default.
- W4311544022 cites W2150543962 @default.
- W4311544022 cites W2222950739 @default.
- W4311544022 cites W2259417104 @default.
- W4311544022 cites W2402519362 @default.
- W4311544022 cites W2404280981 @default.
- W4311544022 cites W2408791203 @default.
- W4311544022 cites W2621397888 @default.
- W4311544022 cites W2791923549 @default.
- W4311544022 cites W2807540482 @default.
- W4311544022 cites W2971911354 @default.
- W4311544022 cites W2993502833 @default.
- W4311544022 cites W3009431883 @default.
- W4311544022 cites W3012211282 @default.
- W4311544022 cites W3021920646 @default.
- W4311544022 cites W3023413819 @default.
- W4311544022 cites W3179810264 @default.
- W4311544022 cites W3183446088 @default.
- W4311544022 cites W4242372416 @default.
- W4311544022 cites W4292162688 @default.
- W4311544022 cites W4306154519 @default.
- W4311544022 doi "https://doi.org/10.1016/j.rechem.2022.100721" @default.
- W4311544022 hasPublicationYear "2023" @default.
- W4311544022 type Work @default.
- W4311544022 citedByCount "0" @default.
- W4311544022 crossrefType "journal-article" @default.
- W4311544022 hasAuthorship W4311544022A5029653950 @default.
- W4311544022 hasAuthorship W4311544022A5063405665 @default.
- W4311544022 hasAuthorship W4311544022A5067466595 @default.
- W4311544022 hasAuthorship W4311544022A5071611751 @default.
- W4311544022 hasAuthorship W4311544022A5072860904 @default.
- W4311544022 hasAuthorship W4311544022A5075087471 @default.
- W4311544022 hasBestOaLocation W43115440221 @default.
- W4311544022 hasConcept C159110408 @default.
- W4311544022 hasConcept C185592680 @default.
- W4311544022 hasConcept C2777278459 @default.
- W4311544022 hasConcept C2780917455 @default.
- W4311544022 hasConcept C2910652673 @default.
- W4311544022 hasConcept C31903555 @default.
- W4311544022 hasConcept C41685203 @default.
- W4311544022 hasConcept C55493867 @default.
- W4311544022 hasConcept C71924100 @default.
- W4311544022 hasConcept C86803240 @default.
- W4311544022 hasConcept C89423630 @default.
- W4311544022 hasConceptScore W4311544022C159110408 @default.
- W4311544022 hasConceptScore W4311544022C185592680 @default.
- W4311544022 hasConceptScore W4311544022C2777278459 @default.
- W4311544022 hasConceptScore W4311544022C2780917455 @default.
- W4311544022 hasConceptScore W4311544022C2910652673 @default.
- W4311544022 hasConceptScore W4311544022C31903555 @default.
- W4311544022 hasConceptScore W4311544022C41685203 @default.
- W4311544022 hasConceptScore W4311544022C55493867 @default.
- W4311544022 hasConceptScore W4311544022C71924100 @default.
- W4311544022 hasConceptScore W4311544022C86803240 @default.
- W4311544022 hasConceptScore W4311544022C89423630 @default.
- W4311544022 hasLocation W43115440221 @default.
- W4311544022 hasLocation W43115440222 @default.
- W4311544022 hasOpenAccess W4311544022 @default.
- W4311544022 hasPrimaryLocation W43115440221 @default.
- W4311544022 hasRelatedWork W1974522561 @default.
- W4311544022 hasRelatedWork W2123311799 @default.
- W4311544022 hasRelatedWork W2886705181 @default.
- W4311544022 hasRelatedWork W2910421252 @default.
- W4311544022 hasRelatedWork W2946449973 @default.
- W4311544022 hasRelatedWork W3022675730 @default.
- W4311544022 hasRelatedWork W3173122162 @default.
- W4311544022 hasRelatedWork W4297252087 @default.
- W4311544022 hasRelatedWork W4300690271 @default.