Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.67 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.67 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.64 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL2741585 | 0.81 | TAAR1 (0.59) | HRH3HRH4CYP19A1TAAR1 | |
| SCHEMBL6028497 | 0.81 | HRH3 (0.68) | HRH3HRH4CYP19A1TAAR1 | |
| SCHEMBL2741604 | 0.77 | HRH4 (0.68) | HRH3HRH4TAAR1 | |
| SCHEMBL224745 | 0.77 | TAAR1 (1.00) | HRH3HRH4TAAR1 | |
| SCHEMBL934227 | 0.75 | TAAR1 (0.73) | TAAR1 | |
| SCHEMBL8963903 | 0.75 | HRH3 (0.73) | HRH3HRH4TAAR1 | |
| SCHEMBL27706452 | 0.74 | TAAR1 (0.59) | TAAR1 | |
| SCHEMBL4321538 | 0.74 | HRH3 (0.68) | HRH3HRH4TAAR1 | |
| SCHEMBL7468703 | 0.73 | HRH3 (0.73) | HRH3HRH4CYP19A1TAAR1 | |
| SCHEMBL18526451 | 0.71 | HRH3 (0.58) | HRH3HRH4TAAR1 |
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-0952842-A2 | A METHOD OF TREATING CANCER | Merck & Co., Inc. (US) | 1999-11-03 | — | — | EP | claimed |
| WO-1997038664-A2 | A METHOD OF TREATING CANCER | MERCK & CO., INC. (US) | 1997-10-23 | — | — | WO | claimed |