Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SSTR5 | P35346 | 2/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3971524 | 0.88 | MAPK1 (0.36) | KCNH2CHEK1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3977954 | 0.87 | TACR1 (0.37) | KCNH2SLC6A2SLC6A4SLC6A3MAPK1 | |
| SCHEMBL3973958 | 0.87 | SSTR5 (0.40) | KCNH2SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL3972925 | 0.86 | MAPK1 (0.44) | KCNH2SLC6A2SLC6A4SLC6A3MAPK1 | |
| SCHEMBL3977612 | 0.84 | SLC6A2 (0.37) | KCNH2SLC6A2SLC6A4SLC6A3MAPK1 | |
| SCHEMBL3971901 | 0.84 | SSTR5 (0.43) | KCNH2SLC6A2SLC6A4SLC6A3MAPK1 | |
| SCHEMBL3977915 | 0.84 | PARP10 (0.39) | KCNH2CHEK1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3980020 | 0.83 | JAK2 (0.37) | DHFRSLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL3973812 | 0.83 | SSTR5 (0.38) | KCNH2SLC6A2SLC6A4SLC6A3TACR1 | |
| SCHEMBL3972873 | 0.83 | SLC6A9 (0.37) | KCNH2SLC6A2SLC6A4SLC6A3MAPK1 |
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 |