Strategic Targeting of Multiple Water-Mediated Interactions: A Concise and Rational Structure-Based Design Approach to Potent and Selective MMP-13 Inhibitors

Dissecting the Hydrophobic Effect on the Molecular Level: The Role of Water, Enthalpy, and Entropy in Ligand Binding to Thermolysin

(2013) Adam Biela et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Potent and selective 2-naphthylsulfonamide substituted hydroxamic acid inhibitors of matrix metalloproteinase-13

(2011) Ruben A. Tommasi et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Selective non zinc binding inhibitors of MMP13

(2011) Chris De Savi et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Identification of novel, exosite-binding matrix metalloproteinase-13 inhibitor scaffolds

(2011) Joshua Roth et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

New Hope for the Treatment of Osteoarthritis Through Selective Inhibition of MMP-13

(2011) N.-G. Li et al.   CURRENT MEDICINAL CHEMISTRY

Identification of novel molecular scaffolds for the design of MMP-13 inhibitors: A first round of lead optimization

(2011) Valeria La Pietra et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Structural Basis for Matrix Metalloproteinase-2 (MMP-2)-selective Inhibitory Action of β-Amyloid Precursor Protein-derived Inhibitor

(2011) Hiroshi Hashimoto et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

Fragment-Based Discovery of Indole Inhibitors of Matrix Metalloproteinase-13

(2011) Steven J. Taylor et al.   JOURNAL OF MEDICINAL CHEMISTRY

Discovery and Evaluation of a Non-Zn Chelating, Selective Matrix Metalloproteinase 13 (MMP-13) Inhibitor for Potential Intra-articular Treatment of Osteoarthritis

(2011) Christian Gege et al.   JOURNAL OF MEDICINAL CHEMISTRY

Site-resolved measurement of water-protein interactions by solution NMR

(2011) Nathaniel V Nucci et al.   NATURE STRUCTURAL & MOLECULAR BIOLOGY

The Intrinsic Protein Flexibility of Endogenous Protease Inhibitor TIMP-1 Controls Its Binding Interface and Affects Its Function

(2010) Moran Grossman et al.   BIOCHEMISTRY

Third generation of matrix metalloprotease inhibitors: Gain in selectivity by targeting the depth of the S1′ cavity

(2010) Laurent Devel et al.   BIOCHIMIE

Heteroarylimino-4-thiazolidinones as inhibitors of cartilage degradation

(2010) Anna Maria Panico et al.   BIOORGANIC CHEMISTRY

Novel Therapies in OA

(2010) Carl R. Flannery   CURRENT DRUG TARGETS

The Role of Water Molecules in Computational Drug Design

(2010) Stephanie de Beer et al.   CURRENT TOPICS IN MEDICINAL CHEMISTRY

Accounting for water molecules in drug design

(2010) Sergio E Wong et al.   Expert Opinion on Drug Discovery

Discovery of (pyridin-4-yl)-2H-tetrazole as a novel scaffold to identify highly selective matrix metalloproteinase-13 inhibitors for the treatment of osteoarthritis

(2009) Mark E. Schnute et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Explicit Treatment of Water Molecules in Protein-Ligand Docking

(2009) Oscar Villacanas et al.   Current Computer-Aided Drug Design

Discovery of Potent, Selective, and Orally Active Carboxylic Acid Based Inhibitors of Matrix Metalloproteinase-13†

(2009) Lauren G. Monovich et al.   JOURNAL OF MEDICINAL CHEMISTRY

Energetics of Displacing Water Molecules from Protein Binding Sites: Consequences for Ligand Optimization

(2009) Julien Michel et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Exploiting Ordered Waters in Molecular Docking

(2008) Niu Huang et al.   JOURNAL OF MEDICINAL CHEMISTRY

Novel Synthesis and Characterization ofN‐Substituted‐calix[4]azacrown Derivatives

(2008) Zhi‐Qiang Shi et al.   SYNTHETIC COMMUNICATIONS

Water as an Active Constituent in Cell Biology

(2007) Philip Ball   CHEMICAL REVIEWS