Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 20/20 | 0.76 |
| ▸ | AKT2 | P31751 | 13/20 | 0.76 |
| ▸ | ROCK2 | O75116 | 12/20 | 0.62 |
| ▸ | AKT3 | Q9Y243 | 10/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.60 |
| ▸ | GSK3B | P49841 | 1/20 | 0.60 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1002157 | 0.86 | AKT1 (1.00) | AKT1AKT2ROCK2AKT3KCNH2 | |
| SCHEMBL16105745 | 0.83 | AKT2 (0.76) | AKT1AKT2ROCK2AKT3KCNH2 | |
| SCHEMBL1001932 | 0.77 | AKT2 (0.75) | AKT1AKT2ROCK2AKT3KCNH2 | |
| SCHEMBL1001031 | 0.77 | AKT2 (1.00) | AKT1AKT2ROCK2AKT3KCNH2 | |
| SCHEMBL1002126 | 0.76 | AKT2 (1.00) | AKT1AKT2ROCK2AKT3KCNH2 | |
| SCHEMBL29367023 | 0.76 | AKT2 (1.00) | AKT1AKT2ROCK2AKT3KCNH2 | |
| SCHEMBL3655624 | 0.76 | AKT1 (0.64) | AKT1AKT2ROCK2AKT3KCNH2 | |
| SCHEMBL15809745 | 0.75 | AKT1 (0.77) | AKT1AKT2ROCK2AKT3KCNH2 | |
| SCHEMBL392420 | 0.75 | AKT1 (1.00) | AKT1AKT2ROCK2AKT3KCNH2 | |
| SCHEMBL1973751 | 0.75 | AKT2 (0.77) | AKT1AKT2ROCK2AKT3KCNH2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1812004-B1 | ORTHO- CONDENSED PYRIDINE AND PYRIMIDINE DERIVATIVES (E. G. PURINES) AS PROTEIN KINASES INHIBITORS | ASTEX THERAPEUTICS LTD (GB) | 2011-06-22 | — | — | EP | claimed |