Allosteric inhibition of SHP2 phosphatase inhibits cancers driven by receptor tyrosine kinases

Ying-Nan P. Chen, Matthew J. LaMarche, Ho Man Chan, +50

Nature

Cancer ResearchAllosteric InhibitionSignal TransductionSignaling PathwayMedicine +10

Polarizable Force Fields:  History, Test Cases, and Prospects

Arieh Warshel, Mitsunori Kato, Andrei V. Pisliakov

Journal of Chemical Theory and Computation

Polarizable Force FieldsBiophysical ModelingElectrohydrodynamicsEngineeringElectrostatic Energies +14

Allosteric Inhibition of SHP2: Identification of a Potent, Selective, and Orally Efficacious Phosphatase Inhibitor

Jorge Fortanet, Christine Hiu-Tung Chen, Ying-Nan P. Chen, +33

Journal of Medicinal Chemistry

Allosteric InhibitionDrug TargetShp2 InhibitionEfficacious Phosphatase InhibitorChemical Biology +18

Identification of TNO155, an Allosteric SHP2 Inhibitor for the Treatment of Cancer

Matthew J. LaMarche, Michael Acker, Andreea Argintaru, +61

Journal of Medicinal Chemistry

Small-molecule WNK inhibition regulates cardiovascular and renal function

Ken Yamada, Hyi-Man Park, Dean F. Rigel, +58

Nature Chemical Biology

Molecular PhysiologyKidney ResearchMedicinePhysiologyPharmacology +6

Apparent NAC Effect in Chorismate Mutase Reflects Electrostatic Transition State Stabilization

Marek Štrajbl, Avital Shurki, Mitsunori Kato, +1

Journal of the American Chemical Society

Chorismate MutaseSignal TransductionBiochemistryNatural SciencesBiocatalysis +13

Dual Allosteric Inhibition of SHP2 Phosphatase

Michelle Fodor, Edmund V. Price, Ping Wang, +23

ACS Chemical Biology

What Are the Roles of Substrate-Assisted Catalysis and Proximity Effects in Peptide Bond Formation by the Ribosome?

Pankaz K. Sharma, Yun Xiang, Mitsunori Kato, +1

Biochemistry

Protein ChemistrySubstrate-assisted CatalysisProtein AssemblyBiochemistryProtein Folding +13

Exploring the origin of the ion selectivity of the KcsA potassium channel

Anton Burykin, Mitsunori Kato, Arieh Warshel

Proteins Structure Function and Bioinformatics

6-Amino-3-methylpyrimidinones as Potent, Selective, and Orally Efficacious SHP2 Inhibitors

Patrick Sarver, Michael Acker, Jeffrey T. Bagdanoff, +27

Journal of Medicinal Chemistry

Medicinal ChemistryAllosteric Shp2 InhibitorsDrug TargetEfficacious Shp2 InhibitorsBiochemistry +13