The Discovery of New Human Coagulation Factor XIa (FXIa) Inhibitors by Synthesis, Biological Evaluation, and Structure-based Modeling
| Autor: | Yong Ju Kim, Nam Sook Kang, Tae Kyo Park, Jinyeong Kim, Myeong Hwi Lee, Park Kyung Eun, Hyoungrae Kim, Ho Young Song |
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| Rok vydání: | 2016 |
| Předmět: |
0301 basic medicine
Molecular model Stereochemistry Chemistry Factor XIa General Chemistry 030204 cardiovascular system & hematology 03 medical and health sciences 030104 developmental biology 0302 clinical medicine Coagulation Biochemistry Coagulation factor XIa Structure based Biological evaluation |
| Zdroj: | Bulletin of the Korean Chemical Society. 37:1105-1113 |
| ISSN: | 1229-5949 |
| Popis: | Factor XIa (FXIa) is an enzyme that is activated during the earliest stage of initiation of the intrinsic pathway of the blood coagulation mechanism. In this study, we attempted to discover a new FXIa inhibitor based on structure-based molecular modeling. We found that compound 16 exhibits satisfactory predicted properties while maintaining important binding interactions with FX1a. |
| Databáze: | OpenAIRE |
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