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Cholinergic system and its therapeutic importance in inflammation and autoimmunity
N Halder, G Lal - Frontiers in immunology, 2021 - frontiersin.org
Neurological and immunological signals constitute an extensive regulatory network in our
body that maintains physiology and homeostasis. The cholinergic system plays a significant …
body that maintains physiology and homeostasis. The cholinergic system plays a significant …
How many kinases are druggable? A review of our current understanding
There are over 500 human kinases ranging from very well-studied to almost completely
ignored. Kinases are tractable and implicated in many diseases, making them ideal targets …
ignored. Kinases are tractable and implicated in many diseases, making them ideal targets …
KLIFS: a knowledge-based structural database to navigate kinase–ligand interaction space
Protein kinases regulate the majority of signal transduction pathways in cells and have
become important targets for the development of designer drugs. We present a systematic …
become important targets for the development of designer drugs. We present a systematic …
Protein flexibility in ligand docking and virtual screening to protein kinases
The main complicating factor in structure-based drug design is receptor rearrangement upon
ligand binding (induced fit). It is the induced fit that complicates cross-docking of ligands …
ligand binding (induced fit). It is the induced fit that complicates cross-docking of ligands …
2, 3-Dihydroquinazolin-4 (1 H)-one as a privileged scaffold in drug design
M Badolato, F Aiello, N Neamati - RSC advances, 2018 - pubs.rsc.org
2, 3-Dihydroquinazolin-4-one (DHQ) belongs to the class of nitrogen-containing heterocyclic
compounds representing a core structural component in various biologically active …
compounds representing a core structural component in various biologically active …
Map kinase p38inhibitors: Clinical results and an intimate look at their interactions with p38α protein
MR Lee, C Dominguez - Current medicinal chemistry, 2005 - ingentaconnect.com
Mitogen-activated protein kinase p38 is a serine/threonine kinase originally isolated from
lipopolysaccharide (LPS) stimulated monocytes. There are four isoforms p38α, p38β, p38γ …
lipopolysaccharide (LPS) stimulated monocytes. There are four isoforms p38α, p38β, p38γ …
Selective p38α inhibitors clinically evaluated for the treatment of chronic inflammatory disorders
DM Goldstein, A Kuglstatter, Y Lou… - Journal of medicinal …, 2010 - ACS Publications
Introduction p38R is a member of the well characterized mitogen activated protein (MAPa)
kinase family of serine/threonine protein kinases. p38R is widely expressed in endothelial …
kinase family of serine/threonine protein kinases. p38R is widely expressed in endothelial …
Structural basis for p38α MAP kinase quinazolinone and pyridol-pyrimidine inhibitor specificity
CE Fitzgerald, SB Patel, JW Becker… - Nature Structural & …, 2003 - nature.com
The quinazolinone and pyridol-pyrimidine classes of p38 MAP kinase inhibitors have a
previously unseen degree of specificity for p38 over other MAP kinases. Comparison of the …
previously unseen degree of specificity for p38 over other MAP kinases. Comparison of the …
Structural biology and drug discovery
G Scapin - Current pharmaceutical design, 2006 - ingentaconnect.com
In the past few years macromolecular crystallography has become a standard technique
used by many pharmaceutical and biotechnology companies. This methodology offers …
used by many pharmaceutical and biotechnology companies. This methodology offers …
Hydrogen bonding penalty upon ligand binding
H Zhao, D Huang - PloS one, 2011 - journals.plos.org
Ligand binding involves breakage of hydrogen bonds with water molecules and formation of
new hydrogen bonds between protein and ligand. In this work, the change of hydrogen …
new hydrogen bonds between protein and ligand. In this work, the change of hydrogen …