Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 5/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.39 |
| ▸ | NOS2 | P35228 | 10/20 | 0.38 |
| ▸ | NOS1 | P29475 | 7/20 | 0.38 |
| ▸ | NOS3 | P29474 | 6/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.38 |
| ▸ | JAK3 | P52333 | 2/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3976469 | 0.90 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3NOS2NOS1 | |
| SCHEMBL3972502 | 0.90 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3NOS2NOS1 | |
| SCHEMBL3973888 | 0.90 | IKBKB (0.40) | SLC6A2SLC6A4SLC6A3JAK2JAK3 | |
| SCHEMBL3972380 | 0.90 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3NOS2NOS1 | |
| SCHEMBL3972421 | 0.88 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3JAK2JAK3 | |
| SCHEMBL3978579 | 0.87 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3NOS2NOS1 | |
| SCHEMBL3972485 | 0.87 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3NOS2NOS1 | |
| SCHEMBL3970914 | 0.87 | IKBKB (0.41) | SLC6A2SLC6A4SLC6A3JAK2JAK3 | |
| SCHEMBL3973911 | 0.87 | SLC6A2 (0.40) | SLC6A2SLC6A4SLC6A3JAK2JAK3 | |
| SCHEMBL3980020 | 0.86 | JAK2 (0.37) | SLC6A2SLC6A4SLC6A3NOS2JAK2 |
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 |