Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 17/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2887258 | 0.74 | SLC6A4 (0.67) | HRH3SLC6A4 | |
| SCHEMBL4360161 | 0.73 | FAAH (0.36) | HRH3ALDH1A1 | |
| SCHEMBL4374335 | 0.71 | HRH3 (0.33) | HRH3SLC6A4 | |
| SCHEMBL3899860 | 0.66 | HRH3 (0.90) | HRH3SLC6A4KDM4EALDH1A1 | |
| SCHEMBL3896583 | 0.65 | HRH3 (0.61) | HRH3SLC6A4 | |
| SCHEMBL2886897 | 0.64 | HRH3 (0.73) | HRH3SLC6A4KDM4EALDH1A1 | |
| SCHEMBL3899432 | 0.64 | HRH3 (0.80) | HRH3SLC6A4 | |
| SCHEMBL2889549 | 0.63 | SLC6A4 (1.00) | HRH3SLC6A4 | |
| SCHEMBL4534084 | 0.63 | HRH3 (0.52) | HRH3SLC6A4 | |
| SCHEMBL3902790 | 0.62 | HRH3 (1.00) | HRH3 |
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-2049466-A1 | BUTYL AND BUTYNYL BENZYL AMINE COMPOUNDS | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008002817-A1 | BUTYL AND BUTYNYL BENZYL AMINE COMPOUNDS | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-01-03 | — | — | WO | disclosed |