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- Thomas S Rush, Jennifer A. Grant, Lidia Mosyak, Anthony Nicholls
- Journal of medicinal chemistry
- 2005
In this paper, we describe the first prospective application of the shape-comparison program ROCS (Rapid Overlay of Chemical Structures) to find new scaffolds for small molecule inhibitors of the… (More)
Molecular mechanism of action of pharmacoperone rescue of misrouted GPCR mutants: the GnRH receptor.
- Jo Ann Janovick, Akshay Patny, +5 authors P. Michael Conn
- Molecular endocrinology
- 2009
The human GnRH receptor (hGnRHR), a G protein-coupled receptor, is a useful model for studying pharmacological chaperones (pharmacoperones), drugs that rescue misfolded and misrouted protein mutants… (More)
- Franklin J. Moy, Pranab Krishna Chanda, +6 authors Robert Powers
- Journal of the American Chemical Society
- 2002
Structure-based approaches for drug design generally do not incorporate solvent effects and dynamic information to predict inhibitor-binding affinity because of practical limitations. The matrix… (More)
- Zangwei Xu, Kumiko Nagashima, +5 authors Ekaterina V. Bobkova
- Journal of biomolecular screening
- 2009
The PI3K/Akt signaling pathway plays a key role in cancer cell growth, survival, and tumor angiogenesis. 3-Phosphoinositide-dependent protein kinase 1 (PDK1) is a Ser/Thr protein kinase, which… (More)
- Thomas S Rush, Robert Powers
- Current topics in medicinal chemistry
- 2004
The following review discusses the successful application of X-ray, NMR, and molecular modeling in the design of potent and selective inhibitors of matrix metalloproteinases (MMPs) and… (More)
- Dongyu Sun, Joon Jung, +5 authors Ilona Kariv
- Combinatorial chemistry & high throughput…
- 2010
A dynamic, focused screening strategy that utilized a limited but diversified set of target-specific compounds was explored as an efficient means for the identification of inhibitors of the protein… (More)