Acelot offers in-silico drug discovery services and solutions for any stage in the drug development pipeline. Acelot's experienced team can help in de-risking your drug discovery pipeline and provide you with high-quality leads for both de-novo design and drug repurposing based on your requirements. Acelot's services can be performed on-site or remotely via secure document sharing. The high lead quality is a result of Acelot's proprietary cheminformatics algorithms for 3D searching and mining that are also offered as stand-alone solutions.
Our services
We provide on-site or remote services for a variety of drug development tasks such as
- Pharmacophore development based on ligand/binding site structure
- Drug repurposing using pathway and binding data
- Structure-activity interpretation and optimization
- Leadlikeness and druglikeness determination and filtering
- Optimization of drug candidates: PKDM, ADME/Tox
- Database mining for substructure motifs
- Identification of medicinal chemistry scaffolds and inputs
Our solutions
Our current suite of tools in the drug discovery and drug development space include tools for
- Screening of large chemical databases and scaffold hopping → SimFinder
- Discovery of active substructures for lead generation and optimization → SigFinder
- ADMET prediction with structural reasoning → ActiPred
- Advanced pharmacophore analysis → PharmaMiner