Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | STK17B | O94768 | 1/20 | 0.34 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.34 |
| ▸ | GPR4 | P46093 | 2/20 | 0.33 |
| ▸ | AKT1 | P31749 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 3/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | ACACA | Q13085 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.31 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL5804885 | 0.86 | MEN1 (0.38) | MEN1KMT2ASTK17BSTK17ACA12 | |
| SCHEMBL5791032 | 0.82 | GPR119 (0.40) | GPR4AKT1ALDH1A1ACACBACACA | |
| SCHEMBL8125809 | 0.81 | ATR (0.42) | MEN1KMT2ASTK17BSTK17AGPR4 | |
| SCHEMBL5306751 | 0.76 | STK17B (0.37) | STK17BSTK17AAKT1CA12CA1 | |
| SCHEMBL5823667 | 0.75 | STK17B (0.43) | STK17BSTK17AAKT1ATRAAK1 | |
| SCHEMBL5305779 | 0.74 | AAK1 (0.36) | STK17BSTK17AATRCA12CA1 | |
| SCHEMBL5306339 | 0.73 | STK17B (0.49) | MEN1KMT2ASTK17BSTK17AAKT1 | |
| SCHEMBL3409879 | 0.72 | MEN1 (0.47) | MEN1KMT2ASTK17BSTK17AALDH1A1 | |
| SCHEMBL8244837 | 0.71 | STK17B (0.42) | MEN1KMT2ASTK17BSTK17AAKT1 | |
| SCHEMBL3176616 | 0.71 | STK17B (0.42) | MEN1KMT2ASTK17BSTK17AAKT1 |
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-2006027211-A1 | 2,4-SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2006-03-16 | — | — | WO | disclosed |