Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.63 |
| ▸ | ROCK2 | O75116 | 13/20 | 0.62 |
| ▸ | ROCK1 | Q13464 | 12/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.62 |
| ▸ | PRKACA | P17612 | 2/20 | 0.62 |
| ▸ | PRKX | P51817 | 2/20 | 0.62 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.62 |
| ▸ | GSK3A | P49840 | 1/20 | 0.62 |
| ▸ | GSK3B | P49841 | 1/20 | 0.62 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.62 |
| ▸ | GRK5 | P34947 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.51 |
| ▸ | PRKCA | P17252 | 1/20 | 0.49 |
| ▸ | GRK2 | P25098 | 1/20 | 0.49 |
| ▸ | MMP13 | P45452 | 1/20 | 0.48 |
| ▸ | METTL3 | Q86U44 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1649632 | 0.86 | ROCK2 (0.61) | ROCK2ROCK1PRKACA | |
| SCHEMBL22531064 | 0.80 | HDAC6 (0.49) | AURKAROCK2ROCK1CYP3A4CYP2D6 | |
| SCHEMBL29379650 | 0.80 | HDAC6 (0.49) | AURKAROCK2ROCK1CYP3A4CYP2D6 | |
| SCHEMBL1648756 | 0.79 | AURKA (0.63) | AURKAROCK2ROCK1CYP3A4CYP2D6 | |
| SCHEMBL1649540 | 0.79 | ROCK2 (0.51) | AURKAROCK2ROCK1CYP3A4CYP2D6 | |
| SCHEMBL22148324 | 0.79 | METTL3 (0.49) | CYP3A4CYP2C9KDM4EEGLN1METTL3 | |
| SCHEMBL1584297 | 0.77 | ROCK2 (1.00) | AURKAROCK2ROCK1CYP3A4CYP2D6 | |
| SCHEMBL12779954 | 0.77 | KDM4E (0.49) | ROCK2ROCK1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL25719243 | 0.74 | ROCK2 (0.93) | AURKAROCK2ROCK1CYP3A4CYP2D6 | |
| SCHEMBL1568252 | 0.74 | ROCK2 (0.86) | AURKAROCK2ROCK1CYP3A4CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011050245-A1 | BICYCLIC HETEROARYLS AS KINASE INHIBITORS | FENG YANGBO (US) | 2011-04-28 | — | — | WO | disclosed |
| WO-2011050245-A1 | BICYCLIC HETEROARYLS AS KINASE INHIBITORS | FENG YANGBO (US) | 2011-04-28 | — | — | WO | disclosed |