Finally, the proposal will explore whether a further increase of anti-tumor efficiency can be obtained by combining Atg4B- and CA-inhibitor pharmacophores
in a single compound.
Forge has been applying its metal-binding pharmacophores
("MBP") library and processes and has been able to identify potent drugable inhibitors of LpxC.
Thus, in order to overcome this state of crisis, a collective effort for the augmentation and synthesis of new drugs has spurred the chemists to search and formulate novel pharmacophores
encompassing significant biological activities .
Forge Therapeutics has been implementing its proprietary metal-binding pharmacophores
library and processes and has been able to identify potent drugable inhibitors of LpxC.
Molecular sampling of the allosteric binding pocket of the TSH receptor provides discriminative pharmacophores
for antagonist and agonists.
Part two discusses methods of scaffold hopping, covering 2D fingerprints, chemically advanced template search (CATS), reduced graphs, feature trees, feature point pharmacophores
, 3D scaffold replacement, spherical harmonic molecular surfaces, XED force field and Spark, molecular interaction fingerprints, and SkelGen.
Besides the exploitation of new targets, there is another approach of merging two or more pharmacophores
into a single molecule.
Characterization of two pharmacophores
on the multidrug transporter P-glycoprotein.
The design and synthesis of hybrid molecules encompassing two pharmacophores
in one molecular scaffold is a well-established approach to the synthesis of more potent drugs with dual activity.
Novel method for generating structure-based pharmacophores
using energetic analysis.
While chiral carbinamines are common pharmacophores
, a green, rapid.
Click Chemistry: 1,2,3-Triazoles as Pharmacophores