Innoventyx Services

Finding new molecules to interact with a biological target is not a new problem. You can buy compounds (lots of compounds and vendors out there), test them in your biological assay, and you may find an active compound… or you may not.

Of course, you can buy a small number of compounds to minimize your risk of failure and high costs (cost of purchasing the compounds, shipping, time to order and receive the compounds, costs of making/purchasing your protein, assay chemicals/kits, people’s time, equipment usage/overhead, etc.), but how do you know your small compound set contained enough diverse compounds to have a decent chance of finding an active hit?

OK, so instead you can then buy lots of compounds (hundreds or thousands of them) to increase your winning odds, but how confident are you that an active compound will be found and with acceptable activity? And how confident are you that such compound will not be a known me-too inhibitor or that the active compound is not suitable for further drug development?

Now your costs have increased a lot more (time, effort, energy, materials, money) and there is more to lose if nothing comes out of this.  Are you willing to buy and test molecules going blind and hoping for the best?

We at Innoventyx know this problem very well. We use our database of 52 million commercially available curated compounds with a rational computational target-based strategy to increase the odds for success by selecting compounds tailored to your target and with the desired mode of action you want in your compounds

Whether your goal is single-target drug therapeutics, multiple biological targets, anti targets, fragment based, reverse fragment based, or eADME, we can help you in several ways. We can design a new scaffold for your target (your proprietary scaffold) based on your observations, what is known/disclosed in the literature, and/or our computational modeling observations and results. If the mode of action is known and this is your approach, we research and identify what the key drivers are for target affinity and activity, develop a computational model that

Establish/Map chemistry space
Identify chemistry opportunities (space holes)
Capture new chemistry space (and new biology)
Create proprietary intellectual property

Potency: Hit to Lead
Selectivity: Target vs Anti-Targets
Duggability: Lead-like/drug-like profile
Brain Penetration: Seek or Avoid
eADME/Tox

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