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Virtual screening services
Quantum is a leading company providing drug screening services in-silico and, thus, delivering to it clients strong inhibitors against variety of target-proteins
We apply our proprietary developed computational technology QUANTUM, which shows outstanding accuracy in forecasting binding affinities. The hit rate of the QUANTUM performance is about 50%, it means that a half of found in silico strong inhibitors would be confirmed in in-vitro testing!!!
Click here to download a brochure about QUANTUM hit Identification technology.
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Title: Low Micromolar Small Molecule Inhibitor of IL-2 |
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Functional Class: Immune System Primary citation: Thanos, C.D.,Randal, M.,Wells, J.A. Potent small-molecule binding to a dynamic hot spot on IL-2. J.Am.Chem.Soc. v125 pp.15280-15281, 2003 |
Abstract Title: Potent small-molecule binding to a dynamic hot spot on IL-2.
Keywords: Short-chain, Proteins, Binding, Sites, D1pw6b_, Immune, 2-guanidino-acetamide, Up-down, Receptor, 4-helical, (homo, Cytokines, Conformation, Bundle, (1pw6:a,, Interleukin-2, Growth, Growth, Factor, Alpha, Hormone;, Extracellular, Sapiens, Cytokine, (il-2), D1pw6a_, Drug, Sulfate, Sapiens), 1pw6a0, Alpha, 2h-pyrazol-3-yl]-piperidin-1-yl}-2-oxo-ethyl)-, Response, 1pw6b0, Region, Binding, Interleukin-2, Homo, Design, Human, Activity, Mainly, Protein, 2-cyclohexyl-n-(2-{4-[5-(2,3-dichloro-phenyl)-, Chain:, Focused compound library, Targeted chemical collection, Pre-selected, Prescreened, Measurement, Estimation, Prediction, Hts, Uhts, High throughput screening, Ultra high-throughput screening, Development, Profiling, Hit, Lead, Hits, Leads, Drug candidate, Chemicals, Entity, Therapeutic agents, Small molecules, In vitro, Novel active compounds, Focused compound library, Targeted hit library, Entities collection, In-vitro, Vendors, Providers, Distributors, Cro, Medicinal chemists, Diverse range, Structurally diverse building blocks, Hit rich collection, Synthesized, Develop new focused arrays, Privileged scaffolds profile, Profiling, Pre-screened, Methods and principles in medicinal chemistry, Synthetic organic, Computational chemistry, Subset of, Broad variety of organic compounds, Diversity analysis, Synthetic tractability and drug like properties, Computer-aided, Optimization,
