Friday, March 20, 2009

The rule 2-0

Recently, Aronov from Vertex pharmaceuticals proposed a general ‘rule of thumb’ termed the 2-0 rule for kinase likeness to discriminating kinase inhibitors from the nonkinase molecules.

For kinase activity, the molecule should have

1) One or more heteroaromatic nitrogen’s,
2) One or more heteroaromatic NH group,
3) It contains one or more aniline, and 
4) It contains one or more nitriles.



Around 78% of the kinase compound passes the 2-0 rule.

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