Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 14/20 | 0.59 |
| ▸ | ROCK1 | Q13464 | 11/20 | 0.59 |
| ▸ | PRKACA | P17612 | 4/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.59 |
| ▸ | PRKX | P51817 | 2/20 | 0.59 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.59 |
| ▸ | GSK3A | P49840 | 1/20 | 0.59 |
| ▸ | GSK3B | P49841 | 1/20 | 0.59 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.59 |
| ▸ | PRKACG | P22612 | 2/20 | 0.58 |
| ▸ | PRKACB | P22694 | 2/20 | 0.58 |
| ▸ | AURKA | O14965 | 1/20 | 0.57 |
| ▸ | GRK5 | P34947 | 1/20 | 0.52 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1647883 | 0.91 | PRKACA (0.58) | ROCK2ROCK1PRKACACYP3A4CYP2D6 | |
| SCHEMBL1647834 | 0.88 | PRKACA (0.77) | ROCK2ROCK1PRKACAPRKACGPRKACB | |
| SCHEMBL1647543 | 0.81 | ROCK1 (0.78) | ROCK2ROCK1PRKACACYP3A4CYP2D6 | |
| SCHEMBL1648061 | 0.78 | PRKACA (0.81) | ROCK2ROCK1PRKACAPRKACGPRKACB | |
| SCHEMBL1649562 | 0.78 | ROCK1 (0.66) | ROCK2ROCK1PRKACACYP3A4CYP2D6 | |
| SCHEMBL12779421 | 0.76 | PRKACA (0.77) | ROCK2ROCK1PRKACACYP3A4CYP2D6 | |
| SCHEMBL1584297 | 0.75 | ROCK2 (1.00) | ROCK2ROCK1PRKACACYP3A4CYP2D6 | |
| SCHEMBL1218492 | 0.74 | PTGER4 (0.82) | PRKACAPRKACGPRKACBPTGER4 | |
| SCHEMBL12779302 | 0.74 | ROCK2 (0.78) | ROCK2ROCK1PRKACACYP3A4CYP2D6 | |
| SCHEMBL1647278 | 0.74 | PRKACA (1.00) | ROCK2ROCK1PRKACAPRKACGPRKACB |
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 |