Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 10/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 10/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | MAPK7 | Q13164 | 3/20 | 0.41 |
| ▸ | HRH2 | P25021 | 5/20 | 0.41 |
| ▸ | HRH1 | P35367 | 5/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3577463 | 0.90 | AURKA (0.44) | AURKAAURKBCHEK1MAPK7HTR1A | |
| SCHEMBL3566263 | 0.89 | AURKA (0.46) | AURKAAURKBCHEK1MAPK7 | |
| SCHEMBL3571883 | 0.85 | AURKA (0.49) | AURKAAURKBCHEK1HRH1HTR1A | |
| SCHEMBL3564710 | 0.84 | DRD3 (0.49) | AURKAAURKBCHEK1MAPK7 | |
| SCHEMBL3568697 | 0.84 | AURKA (0.51) | AURKAAURKBCHEK1MAPK7HRH1 | |
| SCHEMBL3571190 | 0.84 | CHEK1 (0.47) | AURKAAURKBCHEK1HRH2HRH1 | |
| SCHEMBL3567462 | 0.83 | TLR9 (0.51) | AURKAAURKBCHEK1HRH1HTR1A | |
| SCHEMBL3564511 | 0.82 | HRH3 (0.52) | AURKAAURKBCHEK1HRH1HTR1A | |
| SCHEMBL3567104 | 0.82 | CHEK1 (0.46) | AURKAAURKBCHEK1HRH2HRH1 | |
| SCHEMBL3561811 | 0.82 | MAPK7 (0.47) | AURKAAURKBCHEK1MAPK7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1891040-A1 | INTERMEDIATES USEFUL IN THE SYNTHESIS OF ALKYLQUINOLINE AND ALKYLQUINAZOLINE KINASE MODULATORS AND RELATED METHODS OF SYNTHESIS | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-02-27 | — | — | EP | disclosed |
| WO-2006135646-A1 | INTERMEDIATES USEFUL IN THE SYNTHESIS OF ALKYLQUINOLINE AND ALKYLQUINAZOLINE KINASE MODULATORS AND RELATED METHODS OF SYNTHESIS | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-12-21 | — | — | WO | disclosed |