Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | REN | P00797 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 3/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAP4K3 | Q8IVH8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3973911 | 0.85 | SLC6A2 (0.40) | PDE4BRENSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3972925 | 0.83 | MAPK1 (0.44) | ALDH1A1NPSR1RENSLC6A2SLC6A4 | |
| SCHEMBL3973856 | 0.83 | L3MBTL1 (0.47) | ALDH1A1NPSR1REN | |
| SCHEMBL3974580 | 0.83 | REN (0.41) | KDM4EALDH1A1NPSR1RENSLC6A2 | |
| SCHEMBL3977756 | 0.83 | REN (0.41) | KDM4EALDH1A1RENTACR1HTR2A | |
| SCHEMBL3973369 | 0.83 | REN (0.43) | KDM4EALDH1A1NPSR1RENSLC6A2 | |
| SCHEMBL3974286 | 0.82 | REN (0.43) | KDM4EALDH1A1NPSR1REN | |
| SCHEMBL3979346 | 0.79 | REN (0.43) | ALDH1A1RENSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4551389 | 0.79 | MC4R (0.46) | KDM4EALDH1A1RENSLC6A2SLC6A4 | |
| SCHEMBL4544203 | 0.78 | SLC6A2 (0.45) | KDM4EALDH1A1NPSR1RENSLC6A2 |
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 2 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 | disclosed |
| WO-2008019967-A2 | PHENYL, PYRIDINE AND QUINOLINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2008-02-21 | — | — | WO | disclosed |