A computational approach to explore and identify potential herbal inhibitors for the p21-activated kinase 1 (PAK1)

Identification of Pak1 inhibitors using water thermodynamic analysis

(2019) Jayashree Biswal et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Exploration and Comparison of the Geometrical and Physicochemical Properties of an αC Allosteric Pocket in the Structural Kinome

(2018) Noé Sturm et al.   Journal of Chemical Information and Modeling

Anti-Inflammatory, Anti-Diabetic, and Anti-Alzheimer’s Effects of Prenylated Flavonoids from Okinawa Propolis: An Investigation by Experimental and Computational Studies

(2018) Md Shahinozzaman et al.   MOLECULES

From bench (laboratory) to bed (hospital/home): How to explore effective natural and synthetic PAK1-blockers/longevity-promoters for cancer therapy

(2017) Hiroshi Maruta et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Hair Growth Promoting and Anticancer Effects of p21-activated kinase 1 (PAK1) Inhibitors Isolated from Different Parts of Alpinia zerumbet

(2017) Nozomi Taira et al.   MOLECULES

Dietary Sources and Bioactivities of Melatonin

(2017) Xiao Meng et al.   Nutrients

Structure Based docking studies towards exploring potential anti-androgen activity of selected phytochemicals against Prostate Cancer

(2017) Anshika N. Singh et al.   Scientific Reports

BDDCS, the Rule of 5 and drugability

(2016) Leslie Z. Benet et al.   ADVANCED DRUG DELIVERY REVIEWS

Effect of Okinawa Propolis on PAK1 Activity, Caenorhabditis elegans Longevity, Melanogenesis, and Growth of Cancer Cells

(2016) Nozomi Taira et al.   JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY

Artepillin C and Other Herbal PAK1-blockers: Effects on Hair Cell Proliferation and Related PAK1-dependent Biological Function in Cell Culture

(2015) Binh Cao Quan Nguyen et al.   PHYTOTHERAPY RESEARCH

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

(2015) Alexei S. Karpov et al.   ACS Medicinal Chemistry Letters

Glaucarubinone and gemcitabine synergistically reduce pancreatic cancer growth via down-regulation of P21-activated kinases

(2014) Dannel Yeo et al.   CANCER LETTERS

Prediction of the Biological Activity Spectra of Organic Compounds Using the Pass Online Web Resource

(2014) D. A. Filimonov et al.   Chemistry of Heterocyclic Compounds

Cucurbitacin I Induces Protective Autophagy in Glioblastomain Vitroandin Vivo

(2014) Guang Yuan et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

Analysis of antioxidant prenylflavonoids in different parts of Macaranga tanarius, the plant origin of Okinawan propolis

(2014) Shigenori Kumazawa et al.   Asian Pacific Journal of Tropical Medicine

Nymphaeol-A Isolated from Okinawan Propolis Suppresses Angiogenesis and Induces Caspase-Dependent Apoptosis via Inactivation of Survival Signals

(2013) Ikumi Tsuchiya et al.   Evidence-based Complementary and Alternative Medicine

Herbal Therapeutics that Block the Oncogenic Kinase PAK1: A Practical Approach towards PAK1-dependent Diseases and Longevity

(2013) Hiroshi Maruta   PHYTOTHERAPY RESEARCH

Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

(2012) Christopher A. Lipinski et al.   ADVANCED DRUG DELIVERY REVIEWS

PAK1 as a therapeutic target

(2010) Julia V Kichina et al.   EXPERT OPINION ON THERAPEUTIC TARGETS

Estimation of ADME Properties with Substructure Pattern Recognition

(2010) Jie Shen et al.   Journal of Chemical Information and Modeling

PASS-assisted exploration of new therapeutic potential of natural products

(2010) Rajesh Kumar Goel et al.   MEDICINAL CHEMISTRY RESEARCH

AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

(2009) Oleg Trott et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

An Isoform-Selective, Small-Molecule Inhibitor Targets the Autoregulatory Mechanism of p21-Activated Kinase

(2008) Sean W. Deacon et al.   CHEMISTRY & BIOLOGY

A quantitative analysis of kinase inhibitor selectivity

(2008) Mazen W Karaman et al.   NATURE BIOTECHNOLOGY