Expert Design Support
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Drawing on our experience of leading and managing
multi-disciplinary drug discovery project teams, we can
work with clients to:
- Optimise
screening sequences to ensure they are fit for purpose
and can enable delivery of high-quality candidate
molecules
- Apply
cutting-edge techniques such as chemical proteomics
and design of activity-based probes to understand the
biology of a given target or molecule
- Apply
virtual screening and file-mining approaches to
identify novel hit matter
- Analyse
output from high-throughput screens, triaging clusters
of hits and identifying promising starting points
using parameters such as ligand efficiency, lipophilic
efficiency, ADME properties, off-target activity,
binding mode, scope for modification and IP analysis
- Follow up
screening hits rapidly to generate lead series with
demonstrable structure-activity relationships; develop
an understanding of the risks that each template
presents to allow efficient decision making in terms
of series progression or termination
- Optimise lead
series using an holistic approach to deliver
preclinical candidates that meet required biological,
ADME, Pharm Sci and drug-safety properties
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Experience
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We have worked on projects with a wide
variety of requirements e.g.
- Designing
molecules to cross the blood-brain barrier whilst
retaining drug-like properties
- Designing
molecules to be peripherally restricted whilst
retaining oral absorption
- Identifying
and designing kinase inhibitors with slow binding
kinetics
- Designing
molecules that can be delivered by inhaled or topical
routes that show a long duration of action and high
therapeutic index
and targets from
many gene families e.g.
- Enzymes
(including phosphodiesterases, metalloproteinases,
kinases, histone demethylases and acetylases)
- GPCRs
(aminergic, peptidergic, class B); agonists, partial
agonists, antagonists, inverse agonists, orthosteric
and allosteric binders
- Nuclear
hormone receptors
- Ligand- and
voltage-gated ion channels
- Monoamine
transporters
- Protein-protein
interactions
for a number of
disease areas e.g.
- Allergy and
Respiratory
- Anti-viral
and Anti-fungal Diseases
- CNS Disorders
- Gastrointestinal
- Genitourinary
- Parasitic
Diseases
- Obesity
- Oncology
- Pain
- Regenerative
Medicine
- Tissue
Repair
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