Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 20/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 17/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 13/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL935504 | 1.00 | SLC6A4 (0.59) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL1054093 | 1.00 | SLC6A4 (0.59) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL996881 | 1.00 | SLC6A4 (0.59) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL1054091 | 1.00 | SLC6A4 (0.59) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL935502 | 1.00 | SLC6A4 (0.59) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL934215 | 0.90 | SLC6A2 (0.55) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL934214 | 0.90 | SLC6A2 (0.55) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL935667 | 0.89 | SLC6A2 (0.61) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL935669 | 0.89 | SLC6A2 (0.61) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL1053862 | 0.89 | SLC6A2 (0.61) | 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-2454234-A2 | 3-PHENOXYMETHYLPYRROLIDINE COMPOUNDS | Theravance, Inc. (US) | 2012-05-23 | — | — | EP | disclosed |
| WO-2011008666-A2 | 3-PHENOXYMETHYLPYRROLIDINE COMPOUNDS | THERAVANCE, INC. (US) | 2011-01-20 | — | — | WO | disclosed |