Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK3 | O43781 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.40 |
| ▸ | CLK1 | P49759 | 1/20 | 0.40 |
| ▸ | CLK3 | P49761 | 1/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.40 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.40 |
| ▸ | MYLK2 | Q9H1R3 | 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 | |
|---|---|---|---|---|
| SCHEMBL4947101 | 1.00 | DYRK3 (0.42) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR | |
| SCHEMBL2994755 | 0.91 | ALOX5 (0.46) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR | |
| SCHEMBL2994760 | 0.91 | ALOX5 (0.46) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR | |
| SCHEMBL2993651 | 0.91 | TSHR (0.42) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR | |
| SCHEMBL2993647 | 0.91 | TSHR (0.42) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR | |
| SCHEMBL4942268 | 0.91 | ALDH1A1 (0.43) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR | |
| SCHEMBL2989478 | 0.91 | DYRK3 (0.47) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR | |
| SCHEMBL2989471 | 0.91 | DYRK3 (0.47) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR | |
| SCHEMBL2993901 | 0.90 | ALOX5 (0.41) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR | |
| SCHEMBL2993900 | 0.90 | ALOX5 (0.41) | DYRK3ALDH1A1CYP3A4CYP1A2TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1885362-A2 | NOVEL CHEMICAL COMPOUNDS | Smithkline Beecham Corporation (US) | 2008-02-13 | — | — | EP | claimed |
| WO-2006127458-A2 | NOVEL CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-11-30 | — | — | WO | claimed |
| EP-1885362-A2 | NOVEL CHEMICAL COMPOUNDS | Smithkline Beecham Corporation (US) | 2008-02-13 | — | — | EP | disclosed |
| WO-2006127458-A2 | NOVEL CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-11-30 | — | — | WO | disclosed |