Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 10/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL999194 | 1.00 | SLC6A4 (0.43) | SLC6A4SLC6A3SLC6A2KDM4EALDH1A1 | |
| SCHEMBL997429 | 0.85 | TP53 (0.39) | POLBHRH3 | |
| SCHEMBL997427 | 0.85 | TP53 (0.39) | POLBHRH3 | |
| SCHEMBL1002885 | 0.79 | CYP1A2 (0.42) | KDM4EALDH1A1SMN1; SMN2POLB | |
| SCHEMBL1002884 | 0.79 | CYP1A2 (0.42) | KDM4EALDH1A1SMN1; SMN2POLB | |
| SCHEMBL998852 | 0.76 | SLC6A4 (0.41) | SLC6A4SLC6A3SLC6A2KDM4EALDH1A1 | |
| SCHEMBL998851 | 0.76 | SLC6A4 (0.41) | SLC6A4SLC6A3SLC6A2KDM4EALDH1A1 | |
| SCHEMBL1079190 | 0.74 | HTR7 (0.39) | ALDH1A1SMN1; SMN2DRD2HTR2AHTR7 | |
| SCHEMBL1079194 | 0.74 | HTR7 (0.39) | ALDH1A1SMN1; SMN2DRD2HTR2AHTR7 | |
| SCHEMBL1079982 | 0.72 | CYP2C8 (0.35) | SLC6A4DRD2HTR2A |
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-2456436-A1 | 3-PHENOXYMETHYLPYRROLIDINE COMPOUNDS | Theravance, Inc. (US) | 2012-05-30 | — | — | EP | disclosed |
| WO-2011011231-A1 | 3-PHENOXYMETHYLPYRROLIDINE COMPOUNDS | THERAVANCE, INC. (US) | 2011-01-27 | — | — | WO | disclosed |