| Autor: |
Head MS; Physical and Structural Chemistry, SmithKline Beecham Pharmaceuticals, King of Prussia, PA 19406, USA. Martha_S_Head@sbphrd.com, Ryan MD, Lee D, Feng Y, Janson CA, Concha NO, Keller PM, deWolf WE Jr |
| Jazyk: |
angličtina |
| Zdroj: |
Journal of computer-aided molecular design [J Comput Aided Mol Des] 2001 Dec; Vol. 15 (12), pp. 1105-17. |
| DOI: |
10.1023/a:1015976725743 |
| Abstrakt: |
Structure-based design of a combinatorial array was carried out in order to identify non-peptidic thiomethylketone inhibitors of caspases 3 and 8. Five compounds from the designed array were active against caspase 3, and two were active against caspase 8. A 2.5-A resolution co-crystal structure of caspase 3 and a thiomethylketone array member is reported. The structure-based design strategy has proved useful for identifying caspase inhibitors. |
| Databáze: |
MEDLINE |
| Externí odkaz: |
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