Inflammation is a local reaction (response) of living vascularized tissues to endogenous and exogenous stimuli. Inflammation is fundamentally destined to localize and eliminate the causative agent to limit tissue damage. Thus, inflammation is a physiological (protective) response to injury. Acute inflammation is an immediate and early response to an injurious agent, and its duration is relatively short. However, chronic inflammation is a prolonged inflammatory process in which active inflammation, tissue destruction and attempts to repair occur simultaneously. Scientists have study the inflammatory therapy modeling and mechanisms to accelerate the new anti-inflammatory screening and drug discovery research.
Aiming to meet the significant unmet clinical needs in patients with inflammatory diseases, BOC Sciences can design and produce its docking screening-based anti-inflammatory targeted library.
Figure 1. Proposed anti-inflammatory mechanism of compound 1h. (Hua, K. F.; et al. 2013)
Library Design
This library is designed based on data of validated protein interaction signaling pathways, available protein structure data and active protein inhibitors. More than 1,200 potential anti-inflammatory agents have been identified using the docking screening approach targeting the BOC Sciences HTS compound collection.
In addition, we fully consider the following inflammation-connected molecular targets involved in activating other modulators or enhancing defense mechanisms:
Figure 2. Underlying mechanisms in inflammatory bowel disease. (Min-Hsiung, P.; et al. 2020)
Docking Screening-based Anti-inflammatory Targeted Library Characteristics
- No PAINS or toxic substances/unwanted functions: filtered by strict ‘Ro5-like’ physicochemical and most stringent in-house structural filters
- Bioactivity and safety confirmed by preclinical studies and clinical trials
- Structural diversity, medicinal activity, and cellular penetration
- Structural document, IC50, and other chemical and biological data are provided
- Tanimoto index ≥ 0.8
- All compounds are continually updated
- Compound cherry-picking service is provided
What We Deliver
- Delivered within 2 weeks in any customer-preferred format
- Powders, dry films or DMSO solutions formatted in vials, 96 or 384-well plates
- All compounds have a minimum purity of 90% assessed by 1H NMR and HPLC
- Analytical data is provided
BOC Sciences provides professional, rapid and high-quality services of Docking Screening-based Anti-inflammatory Targeted Library design at competitive prices for global customers. Personalized and customized services of Docking Screening-based Anti-inflammatory Targeted Library design can satisfy any innovative scientific study demands. Our clients have direct access to our staff and prompt feedback to their inquiries. If you are interested in our services, please contact us immediately!
References
- Hua, K. F.; et al. Polyenylpyrrole Derivatives Inhibit NLRP3 Inflammasome Activation and Inflammatory Mediator Expression by Reducing Reactive Oxygen Species Production and Mitogen-Activated Protein Kinase Activation. PLoS ONE. 2013, 8(10): e76754.
- Min-Hsiung, P.; et al. Anti-inflammatory activity of natural dietary flavonoids. Food & Function. 2010. 1: 15-31.
