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Selectivity Enhancement Arising from Interactions at the PI3K Unique Pocket
Author(s) -
Jeong Yujeong,
Lee Junghyun,
Lee Yoonji,
Ham Kyungrok,
Choi Sun,
Hong Sungwoo
Publication year - 2012
Publication title -
chemmedchem
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.817
H-Index - 100
eISSN - 1860-7187
pISSN - 1860-7179
DOI - 10.1002/cmdc.201200245
Subject(s) - selectivity , computer science , kinase , pi3k/akt/mtor pathway , phosphatidylinositol , information retrieval , computational biology , combinatorial chemistry , chemistry , biology , biochemistry , signal transduction , catalysis
Unique character: Compound 1 was modified through a knowledge‐based design approach to obtain excellent selectivity toward phosphatidylinositol 3‐kinase (PI3K). This is a useful strategy for enhancing selectivity for PI3K, given access of the inhibitors to a binding pocket unique to this particular kinase.