Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 2/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 8/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | TTK | P33981 | 1/20 | 0.41 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6880656 | 1.00 | AURKB (0.41) | AURKBMAPK8MAPK14MCHR1KDM4E | |
| SCHEMBL6872853 | 0.89 | EPHX2 (0.47) | AURKBMAPK8MAPK14MCHR1MEN1 | |
| SCHEMBL6872847 | 0.89 | EPHX2 (0.47) | AURKBMAPK8MAPK14MCHR1MEN1 | |
| SCHEMBL6869279 | 0.88 | MAPK14 (0.54) | AURKBMAPK8MAPK14MCHR1HTT | |
| SCHEMBL6878449 | 0.88 | MAPK8 (0.41) | AURKBMAPK8MAPK14MCHR1KDM4E | |
| SCHEMBL6878450 | 0.88 | MAPK8 (0.41) | AURKBMAPK8MAPK14MCHR1KDM4E | |
| SCHEMBL6869275 | 0.88 | MAPK14 (0.54) | AURKBMAPK8MAPK14MCHR1HTT | |
| SCHEMBL6873991 | 0.88 | MCHR1 (0.43) | AURKBMAPK8MAPK14MCHR1KDM4E | |
| SCHEMBL6873985 | 0.88 | MCHR1 (0.43) | AURKBMAPK8MAPK14MCHR1KDM4E | |
| SCHEMBL6877414 | 0.87 | KMT2A (0.56) | AURKBMAPK8MAPK14MCHR1MEN1 |
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-1464335-A2 | Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist | Taisho Pharmaceutical Co. Ltd. (JP) | 2004-10-06 | — | — | EP | disclosed |