Matches in SemOpenAlex for { <https://semopenalex.org/work/W4387253316> ?p ?o ?g. }
- W4387253316 abstract "Breast cancer is a major public health concern worldwide, with a need for effective treatments that have minimal side effects. Flavonoids have been shown to have potential as anticancer agents. In this study, the inhibitory effect of flavonoids from Blighia sapida on the breast cancer target, Extracellular signal-regulated kinase 5 (ERK5) was evaluated. A pharmacophore hypothesis was developed based on the interactions between the target protein and its co-crystallized ligand and then applied to the screening of flavonoids present in B. sapida. The top-ranked flavonoids were identified using molecular docking, MMGBSA, and pharmacokinetics modeling, and their inhibitory activity was determined using density functional theory (DFT) and their pIC50 values. The results showed that Quercetin, Kaempferol, and ( +)-Catechin had higher docking scores and obeyed the Lipinski rule of five, indicating their potential as lead molecules for ERK5 inhibition in breast cancer therapy. The study highlights the potential of flavonoids from B. sapida as promising inhibitors of ERK5 for breast cancer management." @default.
- W4387253316 created "2023-10-03" @default.
- W4387253316 creator A5006953176 @default.
- W4387253316 creator A5026789228 @default.
- W4387253316 creator A5030291969 @default.
- W4387253316 creator A5056106219 @default.
- W4387253316 creator A5061853767 @default.
- W4387253316 creator A5075188090 @default.
- W4387253316 creator A5083401319 @default.
- W4387253316 date "2023-10-02" @default.
- W4387253316 modified "2023-10-03" @default.
- W4387253316 title "Virtual screening of flavonoids from Blighia sapida against ERK5 involved in breast cancer" @default.
- W4387253316 cites W1822850048 @default.
- W4387253316 cites W1965173894 @default.
- W4387253316 cites W1983280100 @default.
- W4387253316 cites W1985294501 @default.
- W4387253316 cites W1985588649 @default.
- W4387253316 cites W1995292068 @default.
- W4387253316 cites W1996405087 @default.
- W4387253316 cites W1999491936 @default.
- W4387253316 cites W2005671614 @default.
- W4387253316 cites W2008708918 @default.
- W4387253316 cites W2025795146 @default.
- W4387253316 cites W2055787813 @default.
- W4387253316 cites W2089283797 @default.
- W4387253316 cites W2095663005 @default.
- W4387253316 cites W2095719702 @default.
- W4387253316 cites W2102377211 @default.
- W4387253316 cites W2109838780 @default.
- W4387253316 cites W2136198395 @default.
- W4387253316 cites W2139146032 @default.
- W4387253316 cites W2140017673 @default.
- W4387253316 cites W2143981217 @default.
- W4387253316 cites W2239621362 @default.
- W4387253316 cites W2398240371 @default.
- W4387253316 cites W2398789413 @default.
- W4387253316 cites W2520044912 @default.
- W4387253316 cites W2578119541 @default.
- W4387253316 cites W2794211762 @default.
- W4387253316 cites W2911805741 @default.
- W4387253316 cites W2923005485 @default.
- W4387253316 cites W2943893168 @default.
- W4387253316 cites W2951902079 @default.
- W4387253316 cites W3005533031 @default.
- W4387253316 cites W3047511733 @default.
- W4387253316 cites W3085621749 @default.
- W4387253316 cites W3120340438 @default.
- W4387253316 cites W3129231397 @default.
- W4387253316 cites W3131871520 @default.
- W4387253316 cites W3134655810 @default.
- W4387253316 cites W4206515243 @default.
- W4387253316 cites W4293152353 @default.
- W4387253316 cites W4310778538 @default.
- W4387253316 doi "https://doi.org/10.1007/s43538-023-00210-9" @default.
- W4387253316 hasPublicationYear "2023" @default.
- W4387253316 type Work @default.
- W4387253316 citedByCount "0" @default.
- W4387253316 crossrefType "journal-article" @default.
- W4387253316 hasAuthorship W4387253316A5006953176 @default.
- W4387253316 hasAuthorship W4387253316A5026789228 @default.
- W4387253316 hasAuthorship W4387253316A5030291969 @default.
- W4387253316 hasAuthorship W4387253316A5056106219 @default.
- W4387253316 hasAuthorship W4387253316A5061853767 @default.
- W4387253316 hasAuthorship W4387253316A5075188090 @default.
- W4387253316 hasAuthorship W4387253316A5083401319 @default.
- W4387253316 hasConcept C103697762 @default.
- W4387253316 hasConcept C121608353 @default.
- W4387253316 hasConcept C126322002 @default.
- W4387253316 hasConcept C159110408 @default.
- W4387253316 hasConcept C185592680 @default.
- W4387253316 hasConcept C2777810353 @default.
- W4387253316 hasConcept C2778004101 @default.
- W4387253316 hasConcept C2781263971 @default.
- W4387253316 hasConcept C41685203 @default.
- W4387253316 hasConcept C530470458 @default.
- W4387253316 hasConcept C55493867 @default.
- W4387253316 hasConcept C56173144 @default.
- W4387253316 hasConcept C71924100 @default.
- W4387253316 hasConcept C98274493 @default.
- W4387253316 hasConceptScore W4387253316C103697762 @default.
- W4387253316 hasConceptScore W4387253316C121608353 @default.
- W4387253316 hasConceptScore W4387253316C126322002 @default.
- W4387253316 hasConceptScore W4387253316C159110408 @default.
- W4387253316 hasConceptScore W4387253316C185592680 @default.
- W4387253316 hasConceptScore W4387253316C2777810353 @default.
- W4387253316 hasConceptScore W4387253316C2778004101 @default.
- W4387253316 hasConceptScore W4387253316C2781263971 @default.
- W4387253316 hasConceptScore W4387253316C41685203 @default.
- W4387253316 hasConceptScore W4387253316C530470458 @default.
- W4387253316 hasConceptScore W4387253316C55493867 @default.
- W4387253316 hasConceptScore W4387253316C56173144 @default.
- W4387253316 hasConceptScore W4387253316C71924100 @default.
- W4387253316 hasConceptScore W4387253316C98274493 @default.
- W4387253316 hasLocation W43872533161 @default.
- W4387253316 hasOpenAccess W4387253316 @default.
- W4387253316 hasPrimaryLocation W43872533161 @default.
- W4387253316 hasRelatedWork W2047794220 @default.
- W4387253316 hasRelatedWork W2062768126 @default.
- W4387253316 hasRelatedWork W2071932467 @default.
- W4387253316 hasRelatedWork W2083072426 @default.