Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 10/20 | 0.59 |
| ▸ | ROCK2 | O75116 | 9/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.57 |
| ▸ | PRKACA | P17612 | 3/20 | 0.57 |
| ▸ | PRKX | P51817 | 3/20 | 0.57 |
| ▸ | GSK3A | P49840 | 2/20 | 0.57 |
| ▸ | GSK3B | P49841 | 2/20 | 0.57 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.57 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.57 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.55 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.55 |
| ▸ | PRKCG | P05129 | 1/20 | 0.55 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | AKT1 | P31749 | 1/20 | 0.55 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.55 |
| ▸ | PRKG2 | Q13237 | 1/20 | 0.55 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8375363 | 0.83 | ROCK1 (0.61) | ROCK1ROCK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14724810 | 0.83 | GAA (0.62) | ROCK1ROCK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL30780038 | 0.83 | GAA (0.62) | ROCK1ROCK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL24628436 | 0.81 | ROCK2 (0.60) | ROCK1ROCK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL26940928 | 0.80 | NR1H4 (0.47) | ROCK1ROCK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1569143 | 0.80 | NPC1 (0.73) | ROCK1ROCK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1569176 | 0.80 | L3MBTL1 (0.68) | ROCK1ROCK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7845272 | 0.80 | LMNA (0.62) | ROCK1ROCK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1568252 | 0.80 | ROCK2 (0.86) | ROCK1ROCK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1569194 | 0.79 | ROCK2 (0.82) | ROCK1ROCK2CYP3A4PRKACAPRKX |
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-2443123-B1 | SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) | RIGEL PHARMACEUTICALS INC (US) | 2017-04-05 | — | — | EP | disclosed |