By Stefan Jaroch (Editor), Hilmar Weinmann (Editor)
Chemical genomics is a hugely interdisciplinary and intensely interesting box of analysis either in teachers and within the lifestyles sciences undefined. The Ernst Schering learn origin Workshop fifty eight was once geared up to compile medical leaders within the box to debate the consequences of chemical genomics for drug discovery. a variety of features of the interface among chemistry and biology are lined during this quantity, akin to chemogenomics efforts within the pharmaceutical undefined, diversity-oriented synthesis, chemogenomic methods to the research of cellphone functionality, screening applied sciences, and normal items as instruments in chemical biology.
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Extra info for Chemical Genomics: Small Molecule Probes to Study Cellular Function (Ernst Schering Research Foundation Workshop 58)
References Ballesteros JA, Weinstein H (1995) Integrated methods for the construction of three-dimensional models and computational probing of structure-function relations of G protein-coupled receptors. Meth Neurosci 25:366–428 Bondensgaard K, Ankersen M, Thogersen H, Hansen BS, Wulff BS, Bywater RP (2004) Recognition of privileged structures by G-protein coupled receptors. J Med Chem 47:888–899 Bredel M, Jacoby E (2004) Chemogenomics: an emerging strategy for rapid target and drug discovery. Nat Rev Genet 5:262–275 Caron PR, Mullican MD, Mashal RD, Wilson KP, Su MS, Murcko MA (2001) Chemogenomic approaches to drug discovery.
Along the y-axis the library compounds are shown. Highlighted in yellow or orange are those compounds showing more than 50% or 80% inhibition of radioligand binding at a concentration of 10 µM, respectively Chemogenomics Approaches to Lead Finding b 39 40 T. Klabunde, R. Jäger the afﬁnity observed for other GPCR receptors is limited, resulting in excellent selectivity proﬁles for most of the compounds with A1 afﬁnity; (c) three novel A1 antagonist scaffolds could thus be identiﬁed by proﬁling of subsets taken from ﬁve scaffold libraries.
Often high-throughput screening (HTS) is complemented with rational chemogenomics lead-ﬁnding approaches. Several recent review articles have been published on this novel drug discovery approach, aiming for a clear deﬁnition and trying to set this concept into perspective (Bredel and Jacoby 2004; Jimonet and Jäger 2004; Caron et al. 2001). A shift of pharmaceutical research from traditional target-speciﬁc case-by-case studies to a cross-target view might be considered as the common underlying idea.