Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 2/20 | 0.47 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.47 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.47 |
| ▸ | GPR52 | Q9Y2T5 | 13/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL252286 | 0.78 | PARP1 (0.41) | RPS6KB1PARP1 | |
| SCHEMBL253233 | 0.77 | SYK (0.40) | RPS6KB1GPR52 | |
| SCHEMBL3573175 | 0.75 | NR3C2 (0.57) | AURKARPS6KB1AURKBNR3C2GPR52 | |
| SCHEMBL616941 | 0.75 | DHFR (0.56) | AURKARPS6KB1AURKBCYP1A2CYP3A4 | |
| SCHEMBL248207 | 0.75 | CSF1R (0.43) | AURKARPS6KB1AURKBGPR52 | |
| SCHEMBL2749287 | 0.75 | ALDH1A1 (0.55) | AURKARPS6KB1AURKBNR3C2GPR52 | |
| SCHEMBL247656 | 0.75 | LMNA (0.54) | CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL619841 | 0.74 | LMNA (0.51) | CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL5717652 | 0.74 | PARP1 (0.46) | RPS6KB1AURKBPARP1 | |
| SCHEMBL252708 | 0.73 | MKNK1 (0.48) | PARP1CYP1A2CYP3A4CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2401275-A1 | NOVEL BRONCHODILATING DIAZAHETEROARYLS | Respiratorius AB (SE) | 2012-01-04 | — | — | EP | claimed |
| EP-2401275-B1 | NAPHTHYRIDINE DERIVATIVES HAVING BRONCHODILATING ACTIVITY | RESPIRATORIUS AB (SE) | 2013-07-24 | — | — | EP | disclosed |
| EP-2401275-A1 | NOVEL BRONCHODILATING DIAZAHETEROARYLS | Respiratorius AB (SE) | 2012-01-04 | — | — | EP | disclosed |