Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 16/20 | 0.42 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.39 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.39 |
| ▸ | MBTPS1 | Q14703 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL3974019 | 0.87 | MBTPS1 (0.40) | IRAK4SLC6A9SLC6A5MBTPS1HTR2A | |
| SCHEMBL3969984 | 0.82 | SLC6A2 (0.44) | IRAK4HTR2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3972445 | 0.80 | SSTR5 (0.40) | IRAK4HTR2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4259000 | 0.80 | GCK (0.44) | SLC6A9SLC6A5MBTPS1 | |
| SCHEMBL3971762 | 0.78 | SLC6A2 (0.39) | IRAK4SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4703738 | 0.77 | SLC6A2 (0.48) | IRAK4SLC6A9SLC6A5MBTPS1HTR2A | |
| SCHEMBL3978586 | 0.77 | PROKR1 (0.41) | MBTPS1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4703127 | 0.77 | SLC6A2 (0.44) | IRAK4SLC6A9SLC6A5MBTPS1HTR2A | |
| SCHEMBL4209767 | 0.76 | SLC6A9 (0.38) | SLC6A9SLC6A5MBTPS1HTR2ASLC6A2 | |
| SCHEMBL3977915 | 0.75 | PARP10 (0.39) | SLC6A2SLC6A4SLC6A3 |
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-2054385-A2 | PHENYL, PYRIDINE AND QUINOLINE DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2009-05-06 | — | — | EP | claimed |
| WO-2008019967-A2 | PHENYL, PYRIDINE AND QUINOLINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2008-02-21 | — | — | WO | claimed |
| EP-2054385-A2 | PHENYL, PYRIDINE AND QUINOLINE DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2009-05-06 | — | — | EP | disclosed |
| WO-2008019967-A2 | PHENYL, PYRIDINE AND QUINOLINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2008-02-21 | — | — | WO | disclosed |