A Critical Assessment of Docking Programs and Scoring Functions

Gregory L. Warren, C. Webster Andrews, Anna‐Maria Capelli, +12

Journal of Medicinal Chemistry

EngineeringMolecular BiologyScoring FunctionsProgram EvaluationProtein Folding +21

Pan-PIM Kinase Inhibition Provides a Novel Therapy for Treating Hematologic Cancers

Pablo D. García, John L. Langowski, Yingyun Wang, +31

Clinical Cancer Research

Optimization of a Dibenzodiazepine Hit to a Potent and Selective Allosteric PAK1 Inhibitor

Alexei S. Karpov, Payman Amiri, Cornelia Bellamacina, +23

ACS Medicinal Chemistry Letters

Drug TargetMolecular BiologyPharmacotherapyDibenzodiazepine Hit 1Chemical Biology +14

Inside the Mind of a Medicinal Chemist: The Role of Human Bias in Compound Prioritization during Drug Discovery

Peter S. Kutchukian, Nadya Vasilyeva, Jordan Xu, +5

PLoS ONE

Hit IdentificationOrganic ChemistryChemistryLead CompoundPre-clinical Pharmacology +18

Discovery of Potent and Selective RSK Inhibitors as Biological Probes

Rama Jain, Michelle Mathur, Jiong Lan, +13

Journal of Medicinal Chemistry

Drug TargetChemoprevention StrategyRsk Kinase FamilyChemical BiologyTumor Biology +15

Novel Potent and Selective Inhibitors of p90 Ribosomal S6 Kinase Reveal the Heterogeneity of RSK Function in MAPK-Driven Cancers

Ida Aronchik, B.A. Appleton, Stephen E. Basham, +11

Molecular Cancer Research

Identification of <i>N</i>-(4-((1<i>R</i>,3<i>S</i>,5<i>S</i>)-3-Amino-5-methylcyclohexyl)pyridin-3-yl)-6-(2,6-difluorophenyl)-5-fluoropicolinamide (PIM447), a Potent and Selective Proviral Insertion Site of Moloney Murine Leukemia (PIM) 1, 2, and 3 Kinase Inhibitor in Clinical Trials for Hematological Malignancies

Matthew T. Burger, Gisele Nishiguchi, Wooseok Han, +29

Journal of Medicinal Chemistry

Hematological MalignancyMoloney Murine LeukemiaMedicinal ChemistryKinase InhibitorMedicine +12

Pyrazolopyridines as a novel structural class of potent and selective PDE4 inhibitors

J. Hamblin, Tony D. Angell, Stuart P. Ballantine, +13

Bioorganic & Medicinal Chemistry Letters

Combinatorial ChemistryNovel Structural ClassBiochemistryMedicineRational Drug Design +4

Discovery of novel 3,5-disubstituted indole derivatives as potent inhibitors of Pim-1, Pim-2, and Pim-3 protein kinases

Gisele Nishiguchi, Gordana Atallah, Cornelia Bellamacina, +7

Bioorganic & Medicinal Chemistry Letters

Medicinal ChemistryBiochemistryNatural SciencesMedicinePim-3 Protein Kinases +4

Optimization of novel monobactams with activity against carbapenem-resistant Enterobacteriaceae – Identification of LYS228

Folkert Reck, Alun Bermingham, Johanne Blais, +35

Bioorganic & Medicinal Chemistry Letters

Antimicrobial Drug DiscoveryAntimicrobial SusceptibilityHealth SciencesAntibioticsAntimicrobial Resistance Gene +10