
In 1977, Dr. Larry Hendry and collaborators reported that a wide variety of
biologically active small molecules formed stereospecific interactions with
partially unwound sites in double stranded DNA. These observations led to the
discovery that degree of fit into DNA was predictive of biological activity
among certain classes of molecules. Computer modeling and energy calculations
provided confirmation of these initial observations resulted in the development
of gene-based pharmacophores and search engines for drug development.
Using
patented and proprietary in-silico processes, API has the capability to:
1) (design/optimize) molecules with a high likelihood of possessing a desired
biological activity; and 2) evaluate existing or designed molecules to predict
whether they possess one or more specific biological activities. Using
patent-pending methods, large databases of individual molecules may be evaluated
simultaneously to predict biological activity.
To date, API has employed the technology: 1) in designing novel compounds with
predicted biological activity and degree of bio-activity and 2) in searching
large databases of drug-like compounds for potential lead candidates of desired
biological activity.
Validation has been shown in vitro and in vivo. Search results of
stereo-chemically accurate databases culled with the technology show enrichment
rates in desired bio-activity well above industry standard.