Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CG | P48736 | 2/20 | 0.49 |
| ▸ | ITK | Q08881 | 9/20 | 0.47 |
| ▸ | LCK | P06239 | 8/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 6/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | CLK3 | P49761 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2396976 | 1.00 | PIK3CG (0.49) | PIK3CGITKLCKAURKBFYN | |
| SCHEMBL12291555 | 0.91 | PIK3CD (0.43) | PIK3CGITKLCKAURKBFYN | |
| SCHEMBL2401269 | 0.85 | PIK3CD (0.60) | PIK3CGITKLCKAURKBFYN | |
| SCHEMBL2401283 | 0.85 | PIK3CD (0.60) | PIK3CGITKLCKAURKBFYN | |
| SCHEMBL2397731 | 0.83 | ITK (0.50) | ITKLCKAURKBIRAK4EGFR | |
| SCHEMBL2397725 | 0.83 | ITK (0.50) | ITKLCKAURKBIRAK4EGFR | |
| SCHEMBL2395099 | 0.82 | ITK (0.43) | ITKLCKAURKBCLK2CLK3 | |
| SCHEMBL2395088 | 0.82 | ITK (0.43) | ITKLCKAURKBCLK2CLK3 | |
| SCHEMBL2396521 | 0.80 | DYRK1A (0.41) | ITKLCKAURKBDYRK1AIRAK4 | |
| Trifluoroacetic Acid SCHEMBL2370610 | 0.79 | IRAK4 (0.41) | ITKLCKAURKBBRAFCLK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011110575-A1 | DERIVATIVES OF 2-[2-(BENZO- OR PYRIDO-) THIAZOLYLAMINO]-6-AMINOPYRIDINE, USEFUL IN THE TREATMENT OF RESPIRATORIC, ALLERGIC OR INFLAMMATORY DISEASES | GLAXO GROUP LIMITED (GB) | 2011-09-15 | — | — | WO | disclosed |