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Establishing wonder oil, Solanesol, as a novel inhibitor for Focal Adhesive Kinase by in silico strategies

https://doi.org/10.1101/086660
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inferredcites →https://doi.org/10.1002/(sici)1096-987x(199709)18:12<1463::aid-jcc4>3.0.co;2-hopenalex-snapshot
LINCS: A linear constraint solver for molecular simulations
inferredcites →https://doi.org/10.1002/9783527678679.dg08217openalex-snapshot
National Center for Biotechnology Information (NCBI)
inferredcites →https://doi.org/10.1002/jcc.20084openalex-snapshot
UCSF Chimera—A visualization system for exploratory research and analysis
inferredcites →https://doi.org/10.1002/jcc.21256openalex-snapshot
AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility
inferredcites →https://doi.org/10.1002/jlcr.3083openalex-snapshot
A convergent stereocontrolled synthesis of [3‐14C]solanesol
inferredcites →https://doi.org/10.1007/bf00355047openalex-snapshot
PRODRG, a program for generating molecular topologies and unique molecular descriptors from coordinates of small molecules
inferredcites →https://doi.org/10.1007/s11101-015-9393-5openalex-snapshot
Solanesol: a review of its resources, derivatives, bioactivities, medicinal applications, and biosynthesis
inferredcites →https://doi.org/10.1007/s11676-007-0013-0openalex-snapshot
Distribution of solanesol in Nicotiana tabacum
inferredcites →https://doi.org/10.1016/j.bcp.2006.08.011openalex-snapshot
Focal adhesion kinase: A potential target in cancer therapy
inferredcites →https://doi.org/10.1016/j.cell.2011.02.013openalex-snapshot
Hallmarks of Cancer: The Next Generation
inferredcites →https://doi.org/10.1016/j.febslet.2006.01.074openalex-snapshot
Blind docking of drug‐sized compounds to proteins with up to a thousand residues
inferredcites →https://doi.org/10.1016/s0021-9673(00)89321-8openalex-snapshot
Gas chromatographic method for the determination of free and total solanesol in tobacco
inferredcites →https://doi.org/10.1016/s0092-8674(00)81683-9openalex-snapshot
The Hallmarks of Cancer
inferredcites →https://doi.org/10.1016/s1357-2725(97)00051-4openalex-snapshot
Role of focal adhesion kinase in integrin signaling
inferredcites →https://doi.org/10.1021/ci200274qopenalex-snapshot
DSX: A Knowledge-Based Scoring Function for the Assessment of Protein–Ligand Complexes
inferredcites →https://doi.org/10.1021/ci500020mopenalex-snapshot
g_mmpbsa —A GROMACS Tool for High-Throughput MM-PBSA Calculations
inferredcites →https://doi.org/10.1021/ct700301qopenalex-snapshot
GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation
inferredcites →https://doi.org/10.1021/jm500669mopenalex-snapshot
Discovery of Selective and Orally Bioavailable Protein Kinase Cθ (PKCθ) Inhibitors from a Fragment Hit
inferredcites →https://doi.org/10.1023/a:1008763014207openalex-snapshot
Combined molecular mechanical and continuum solvent approach (MM-PBSA/GBSA) to predict ligand binding
inferredcites →https://doi.org/10.1038/nrc2827openalex-snapshot
What are the hallmarks of cancer?
inferredcites →https://doi.org/10.1063/1.464397openalex-snapshot
Particle mesh Ewald: An N ⋅log( N ) method for Ewald sums in large systems
inferredcites →https://doi.org/10.1093/nar/gkv951openalex-snapshot
PubChem Substance and Compound databases
inferredcites →https://doi.org/10.1110/ps.0202302openalex-snapshot
Efficient docking of peptides to proteins without prior knowledge of the binding site
inferredcites →https://doi.org/10.1111/j.1349-7006.1990.tb02532.xopenalex-snapshot
Synergistic Effect in Culture of Bleomycin‐group Antibiotics and N‐Solanesyl‐N, N’‐bis(3,4‐dimethoxybenzyl)ethylenediamine, a Synthetic Isoprenoid
inferredcites →https://doi.org/10.1111/j.1349-7006.1990.tb02564.xopenalex-snapshot
Cytocidal Activity of a Synthetic Isoprenoid, N‐Solanesyl‐N, N′‐bis(3,4‐dimethoxy‐benzyl)ethylenediamine, and Its Potentiation of Antitumor Drugs against Multidrug‐resistant and Sensitive Cells in vitro
inferredcites →https://doi.org/10.2174/156800905774932798openalex-snapshot
Mechanisms of Focal Adhesion Kinase Regulation
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