Insights into mechanism of anticancer activity of pentacyclic oxindole alkaloids of Uncaria tomentosa by means of a computational reverse virtual screening and molecular docking approach

Catʼs Claw Oxindole Alkaloid Isomerization Induced by Cell Incubation and Cytotoxic Activity against T24 and RT4 Human Bladder Cancer Cell Lines

(2013) Samuel Kaiser et al.   PLANTA MEDICA

Uncaria tomentosa Exerts Extensive Anti-Neoplastic Effects against the Walker-256 Tumour by Modulating Oxidative Stress and Not by Alkaloid Activity

(2013) Arturo Alejandro Dreifuss et al.   PLoS One

Enhanced proapoptotic response of the promyelocytic leukemia HL-60 cells treated with an Uncaria tomentosa alkaloid preparation

(2013) Radosław Pilarski et al.   Journal of Herbal Medicine

Target fishing and docking studies of the novel derivatives of aryl-aminopyridines with potential anticancer activity

(2012) Slavica Erić et al.   BIOORGANIC & MEDICINAL CHEMISTRY

Design, development and evaluation of novel dual PPARδ/PPARγ agonists

(2012) Symon Gathiaka et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

HDM2 antagonist MI-219 (spiro-oxindole), but not Nutlin-3 (cis-imidazoline), regulates p53 through enhanced HDM2 autoubiquitination and degradation in human malignant B-cell lymphomas

(2012) Angela M Sosin et al.   Journal of Hematology & Oncology

Design, synthesis and antiproliferative activities of biarylolefins based on polyhydroxylated and carbohydrate scaffolds

(2011) Alexandre Novoa et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

ReverseScreen3D: A Structure-Based Ligand Matching Method To Identify Protein Targets

(2011) Sarah L. Kinnings et al.   Journal of Chemical Information and Modeling

Isoindolinone Inhibitors of the Murine Double Minute 2 (MDM2)-p53 Protein−Protein Interaction: Structure−Activity Studies Leading to Improved Potency

(2011) Ian R. Hardcastle et al.   JOURNAL OF MEDICINAL CHEMISTRY

Akti-1/2, an allosteric inhibitor of Akt 1 and 2, efficiently inhibits CaMKIα activity and aryl hydrocarbon receptor pathway

(2010) David Gilot et al.   CHEMICO-BIOLOGICAL INTERACTIONS

NWChem: A comprehensive and scalable open-source solution for large scale molecular simulations

(2010) M. Valiev et al.   COMPUTER PHYSICS COMMUNICATIONS

The synthesis, structure and activity evaluation of pyrogallol and catechol derivatives as Helicobacter pylori urease inhibitors

(2010) Zhu-Ping Xiao et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Akt inhibitor enhances apoptotic effect of carboplatin on human epithelial ovarian carcinoma cell lines

(2010) Chung Soo Lee et al.   EUROPEAN JOURNAL OF PHARMACOLOGY

Targeting Bcr–Abl by combining allosteric with ATP-binding-site inhibitors

(2010) Jianming Zhang et al.   NATURE

PharmMapper server: a web server for potential drug target identification using pharmacophore mapping approach

(2010) Xiaofeng Liu et al.   NUCLEIC ACIDS RESEARCH

Design, synthesis, and X-ray crystal structures of 2,4-diaminofuro[2,3-d]pyrimidines as multireceptor tyrosine kinase and dihydrofolate reductase inhibitors

(2009) Aleem Gangjee et al.   BIOORGANIC & MEDICINAL CHEMISTRY

Aryldiketo Acids Have Antibacterial Activity Against MDRStaphylococcus aureusStrains: Structural Insights Based on Similarity and Molecular Interaction Fields

(2009) Branko J. Drakulić et al.   ChemMedChem

Cytotoxic Effect of the Pentacyclic Oxindole Alkaloid Mitraphylline Isolated fromUncaria tomentosaBark on Human Ewing's Sarcoma and Breast Cancer Cell Lines

(2009) Dolores García Giménez et al.   PLANTA MEDICA

Pivotal role of dihydrofolate reductase knockdown in the anticancer activity of 2-hydroxyoleic acid

(2009) V. Llado et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

PDTD: a web-accessible protein database for drug target identification

(2008) Zhenting Gao et al.   BMC BIOINFORMATICS

Identification of a Potent, Selective, and Orally Active Leukotriene A4Hydrolase Inhibitor with Anti-Inflammatory Activity

(2008) Cheryl A. Grice et al.   JOURNAL OF MEDICINAL CHEMISTRY

13C, 15N CPMAS NMR and GIAO DFT calculations of stereoisomeric oxindole alkaloids from Cat's Claw (Uncaria tomentosa)

(2008) Katarzyna Paradowska et al.   SOLID STATE NUCLEAR MAGNETIC RESONANCE

Antitumor studies. Part 4: Design, synthesis, antitumor activity, and molecular docking study of novel 2-substituted 2-deoxoflavin-5-oxides, 2-deoxoalloxazine-5-oxides, and their 5-deaza analogs

(2007) Hamed I. Ali et al.   BIOORGANIC & MEDICINAL CHEMISTRY

N-(3-(Phenylcarbamoyl)arylpyrimidine)-5-carboxamides as potent and selective inhibitors of Lck: Structure, synthesis and SAR

(2007) Holly L. Deak et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS