Characterization of molecular recognition of STAT3 SH2 domain inhibitors through molecular simulation

SH2 domain binding to phosphopeptide ligands: potential for drug targeting

(2009) Moses et al.   Frontiers in Bioscience-Landmark

Conformationally Constrained Peptidomimetic Inhibitors of Signal Transducer and Activator of Transcription 3: Evaluation and Molecular Modeling

(2009) Pijus K. Mandal et al.   JOURNAL OF MEDICINAL CHEMISTRY

Chemical Probes that Competitively and Selectively Inhibit Stat3 Activation

(2009) Xuejun Xu et al.   PLoS One

Crystal structure of unphosphorylated STAT3 core fragment

(2008) Zhiyong Ren et al.   BIOCHEMICAL AND BIOPHYSICAL RESEARCH COMMUNICATIONS

Binding is not enough: Flexibility is needed for photocrosslinking of Lck kinase by benzophenone photoligands

(2008) Akira Kawamura et al.   BIOORGANIC & MEDICINAL CHEMISTRY

Discovery of the catechol structural moiety as a Stat3 SH2 domain inhibitor by virtual screening

(2008) Wenshan Hao et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Restricted Mobility of Conserved Residues in Protein-Protein Interfaces in Molecular Simulations

(2008) Osman N. Yogurtcu et al.   BIOPHYSICAL JOURNAL

Cryptotanshinone Inhibits Constitutive Signal Transducer and Activator of Transcription 3 Function through Blocking the Dimerization in DU145 Prostate Cancer Cells

(2008) D.-S. Shin et al.   CANCER RESEARCH

Molecular Approaches towards the Inhibition of the Signal Transducer and Activator of Transcription 3 (Stat3) Protein

(2008) Steven Fletcher et al.   ChemMedChem

Do enthalpy and entropy distinguish first in class from best in class?

(2008) E FREIRE   DRUG DISCOVERY TODAY

Targeting STAT3 in cancer: how successful are we?

(2008) Peibin Yue et al.   EXPERT OPINION ON INVESTIGATIONAL DRUGS

CH/π hydrogen bonds determine the selectivity of the Src homology 2 domain to tyrosine phosphotyrosyl peptides: Anab initiofragment molecular orbital study

(2008) Tomonaga Ozawa et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Contributions of the Raf/MEK/ERK, PI3K/PTEN/Akt/mTOR and Jak/STAT pathways to leukemia

(2008) L S Steelman et al.   LEUKEMIA

Binding specificity of SH2 domains: Insight from free energy simulations

(2008) Wenxun Gan et al.   PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS

Design, synthesis, and studies of small molecule STAT3 inhibitors

(2007) Deepak Bhasin et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS