Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
10595248 | Bioorganic & Medicinal Chemistry Letters | 2012 | 4 Pages |
Abstract
VRAF murine sarcoma viral oncogene homologue B1 (BRAF) kinase has been considered to be a promising therapeutic target for various human cancers. We have been able to identify 24 novel BRAF kinase inhibitors with Kd values ranging from 0.4 to 10 μM utilizing a structure-based de novo design method with the two known inhibitor scaffolds. Because these discovered inhibitors were also screened for having desirable physicochemical properties as a drug candidate, they deserve consideration for further investigation as anticancer agents. Structural features relevant to the stabilization of the newly identified inhibitors in the ATP-binding site of BRAF are discussed in detail.
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Authors
Hwangseo Park, Yujeong Jeong, Sungwoo Hong,