Titlebook: Small Molecule — Protein Interactions; H. Waldmann,M. Koppitz Conference proceedings 2003 Springer-Verlag Berlin Heidelberg 2003 Combinato

Gratuitous

NMR in Medicinal Chemistry, measure properties and observe changes at individual atomic positions even in very complex systems. While the analysis of molecular structures still is the main goal of classical NMR investigations, it has been realised more recently that NMR spectroscopy also offers unique possibilities to study i

stress-response

Creating Knowledge from High-Throughput Screening Data,automated process that operates on an industrial scale. The current screening capacities of pharmaceutical HTS units are actually reaching tens of thousands compounds per day, and even this throughput performance is constantly challenged by advances in miniaturization and automation technology (Wild

火花

红肿

步兵

analogous

Discovery of New MCRs, Chemical Evolution and Lead Optimization, cephalosporins, macrolides), antifungal agents (amphotericin, nystatin, cancidas), statins (lovastatin, pravastatin), immunosuppressants (cyclosporine A, tacrolimus, sirolimus, mycophenolic acid), antiparasitics (avermectins and polyethers), anti-cancer products (paclitaxel, ectinasceidin, epothilo

提炼

The Impact of Combinatorial Chemistry on Drug Discovery, which was increasingly emphasizing medical need and patient benefit (pharmaco-economics). This resulted in the “industrialization of discovery” and companies invested heavily in high-throughput technologies such as genomics, screening (HTS), and combinatorial chemistry (CC). The question is, have t

天真

Chemical Genomics of Orphan Nuclear Receptors,ption factors are designated orphan receptors since they do not bind to the classical endocrine hormones. Characterization of the biological function of the orphan nuclear receptors has become an important endeavor of biomedical research, since each of them has the potential to be the regulator of a new hormone signaling pathway (Giguere 1999).

爱得痛了

From Structure to Recognition Principles: Mining in Crystal Data as a Prerequisite for Drug Design,ria that was pronouncing the end of any rational or knowledge-based approach to lead discovery has been superseded by a more realistic view, mainly as a result of the considerable costs involved and disappointingly low hit rates (Lahana 1999).

uncertain

,From Protein Domains to Drug Candidates — Natural Products as Guiding Principles in Compound Librar to undertake this Herculean task. But as the universe of thinkable chemical compounds is almost infinite (Bohacek et al. 1996), one important question arises: Where in the universe of chemical structures are compounds with the desired biological properties to be found?