Natural products for drug discovery in the 21st century: innovations for novel drug discovery
The therapeutic properties of plants have been recognised since time immemorial. Many
pathological conditions have been treated using plant-derived medicines. These medicines …
pathological conditions have been treated using plant-derived medicines. These medicines …
Natural product drug discovery in the artificial intelligence era
Natural products (NPs) are primarily recognized as privileged structures to interact with
protein drug targets. Their unique characteristics and structural diversity continue to marvel …
protein drug targets. Their unique characteristics and structural diversity continue to marvel …
Counting on natural products for drug design
Natural products and their molecular frameworks have a long tradition as valuable starting
points for medicinal chemistry and drug discovery. Recently, there has been a revitalization …
points for medicinal chemistry and drug discovery. Recently, there has been a revitalization …
The Chemistry Development Kit (CDK) v2. 0: atom ty**, depiction, molecular formulas, and substructure searching
Abstract Background The Chemistry Development Kit (CDK) is a widely used open source
cheminformatics toolkit, providing data structures to represent chemical concepts along with …
cheminformatics toolkit, providing data structures to represent chemical concepts along with …
[HTML][HTML] The role of natural products as sources of therapeutic agents for innovative drug discovery
K Dzobo - Comprehensive pharmacology, 2022 - ncbi.nlm.nih.gov
Emerging threats to human health require a concerted effort in search of both preventive and
treatment strategies, placing natural products at the center of efforts to obtain new therapies …
treatment strategies, placing natural products at the center of efforts to obtain new therapies …
Modulators of protein–protein interactions
Since Hedin's characterization of trypsin and antitrypsin in 1906,(1) arguably the first
account of a regulatory protein–protein interaction (PPI), contemporary understanding of …
account of a regulatory protein–protein interaction (PPI), contemporary understanding of …
Recent advances in scaffold hop**: miniperspective
Scaffold hop** refers to the computer-aided search for active compounds containing
different core structures, which is a topic of high interest in medicinal chemistry. Herein …
different core structures, which is a topic of high interest in medicinal chemistry. Herein …
Diversity-oriented synthesis as a tool for the discovery of novel biologically active small molecules
Biologically active molecules can be identified through the screening of small-molecule
libraries. Deficiencies in current compound collections are evidenced by the continuing …
libraries. Deficiencies in current compound collections are evidenced by the continuing …
Charting, navigating, and populating natural product chemical space for drug discovery
H Lachance, S Wetzel, K Kumar… - Journal of medicinal …, 2012 - ACS Publications
STRONGHOLDS FOR DRUG DISCOVERY Historically, natural products (NPs) have played
a key role in the development of chemotherapy, 1, 2 and to this very day numerous marketed …
a key role in the development of chemotherapy, 1, 2 and to this very day numerous marketed …
Biology-oriented synthesis: harnessing the power of evolution
H Van Hattum, H Waldmann - Journal of the American Chemical …, 2014 - ACS Publications
For scientists to gain a better understanding of nature, biological research is greatly aided by
small-molecule modulators that perturb protein activity without fundamentally altering the …
small-molecule modulators that perturb protein activity without fundamentally altering the …