Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 14/20 | 0.36 |
| ▸ | AURKA | O14965 | 5/20 | 0.34 |
| ▸ | TTK | P33981 | 5/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 5/20 | 0.34 |
| ▸ | INCENP | Q9NQS7 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | JAK3 | P52333 | 2/20 | 0.32 |
| ▸ | BMX | P51813 | 2/20 | 0.32 |
| ▸ | TEC | P42680 | 1/20 | 0.32 |
| ▸ | TXK | P42681 | 1/20 | 0.32 |
| ▸ | ITK | Q08881 | 1/20 | 0.32 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL171447 | 0.74 | BTK (0.54) | BTKAURKATTKAURKBINCENP | |
| SCHEMBL171471 | 0.71 | BTK (0.67) | BTKBMXITKKDM4EMEN1 | |
| SCHEMBL13894283 | 0.70 | BTK (0.53) | BTKAURKATTKAURKBINCENP | |
| SCHEMBL13894036 | 0.67 | ITK (0.54) | BTKMAPTJAK3BMXITK | |
| SCHEMBL13894035 | 0.67 | TAS1R3 (0.50) | AURKATTKAURKBINCENPMAPT | |
| SCHEMBL171444 | 0.66 | BTK (0.45) | BTKMAPTJAK3BMXMEN1 | |
| SCHEMBL13893955 | 0.65 | DHPS (0.51) | BTKALDH1A1LMNA | |
| SCHEMBL13893940 | 0.63 | BTK (0.53) | BTKMAPTJAK3BMXKDM4E | |
| SCHEMBL19785758 | 0.59 | KDR (0.43) | BTKMAPTKDM4EALDH1A1LMNA | |
| SCHEMBL11448667 | 0.58 | AURKB (0.56) | AURKATTKAURKBINCENPMAPT |
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-2426109-A1 | NOVEL KINASE INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-03-07 | — | — | EP | disclosed |