Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 12/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 11/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 11/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1463404 | 0.76 | HRH4 (0.40) | SLC6A4SLC6A2HRH4NPC1RAB9A | |
| SCHEMBL1558582 | 0.74 | PIK3CG (0.43) | SLC6A4SLC6A2SLC6A3NPC1RAB9A | |
| SCHEMBL1463269 | 0.74 | PIK3CG (0.43) | SLC6A4SLC6A2SLC6A3NPC1RAB9A | |
| SCHEMBL20023738 | 0.70 | PDE10A (0.39) | HRH4NPC1RAB9A | |
| SCHEMBL1463401 | 0.68 | PIK3CA (0.45) | IRAK4 | |
| SCHEMBL2609314 | 0.67 | HRH4 (0.49) | HRH4NPC1RAB9AADORA3 | |
| SCHEMBL31649418 | 0.67 | HRH4 (0.45) | HRH4NPC1RAB9AADORA3 | |
| SCHEMBL4725394 | 0.66 | PIK3CG (0.53) | HRH4ADORA3 | |
| SCHEMBL30889393 | 0.65 | FGFR3 (0.46) | HRH4ADORA3 | |
| SCHEMBL5979418 | 0.64 | SLC6A2 (0.31) | SLC6A4SLC6A2SLC6A3CYP2D6 |
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-2303871-A1 | PYRROLIDIN-3-YLMETHYL-AMINE AS OREXIN ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2011-04-06 | — | — | EP | disclosed |
| WO-2010012620-A1 | PYRROLIDIN-3-YLMETHYL-AMINE AS OREXIN ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-02-04 | — | — | WO | disclosed |