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Synthesis, biological evaluation and molecular docking studies of 2-piperazin-1-yl-quinazolines as platelet aggregation inhibitors and ligands of integrin αIIbβ3
AA. Krysko, AY. Kornylov, PG. Polishchuk, GV. Samoylenko, OL. Krysko, TA. Kabanova, VCh. Kravtsov, VM. Kabanov, B. Wicher, SA. Andronati,
Jazyk angličtina Země Anglie, Velká Británie
Typ dokumentu časopisecké články, práce podpořená grantem
- MeSH
- agregace trombocytů účinky léků MeSH
- chinazoliny chemie farmakologie MeSH
- inhibitory agregace trombocytů chemie farmakologie MeSH
- lidé MeSH
- ligandy MeSH
- piperaziny chemie farmakologie MeSH
- simulace molekulového dockingu MeSH
- trombocytový glykoproteinový komplex IIb-IIIa metabolismus MeSH
- trombocyty cytologie účinky léků metabolismus MeSH
- Check Tag
- lidé MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
A series of 2-piperazin-1-yl-quinazolines were synthesized and evaluated for their antiaggregative activity. The synthesized small molecule compounds have potently inhibited platelet aggregation in vitro and blocked FITC-Fg binding to αIIbβ3 integrin in a suspension of washed human platelets. The key αIIbβ3 protein-ligand interactions were determined in docking experiments and some correlations have been observed between values of the affinity and docking scores.
Citace poskytuje Crossref.org
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- $a A series of 2-piperazin-1-yl-quinazolines were synthesized and evaluated for their antiaggregative activity. The synthesized small molecule compounds have potently inhibited platelet aggregation in vitro and blocked FITC-Fg binding to αIIbβ3 integrin in a suspension of washed human platelets. The key αIIbβ3 protein-ligand interactions were determined in docking experiments and some correlations have been observed between values of the affinity and docking scores.
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