Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 15/20 | 0.49 |
| ▸ | HTR1D | P28221 | 14/20 | 0.49 |
| ▸ | HTR1A | P08908 | 3/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 5/20 | 0.44 |
| ▸ | GHSR | Q92847 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6611704 | 1.00 | HTR1B (0.49) | HTR1BHTR1DHTR1ANOTUMGHSR | |
| SCHEMBL6611708 | 1.00 | HTR1B (0.49) | HTR1BHTR1DHTR1ANOTUMGHSR | |
| SCHEMBL6604255 | 0.86 | HTR1B (0.50) | HTR1BHTR1DHTR1ANOTUMGHSR | |
| SCHEMBL6604254 | 0.86 | HTR1B (0.50) | HTR1BHTR1DHTR1ANOTUMGHSR | |
| SCHEMBL6609195 | 0.85 | HTR1B (0.48) | HTR1BHTR1DHTR1ANOTUMGHSR | |
| SCHEMBL6609198 | 0.85 | HTR1B (0.48) | HTR1BHTR1DHTR1ANOTUMGHSR | |
| SCHEMBL6604290 | 0.85 | HTR1B (0.54) | HTR1BHTR1DHTR1ANOTUMGHSR | |
| SCHEMBL6604293 | 0.85 | HTR1B (0.54) | HTR1BHTR1DHTR1ANOTUMGHSR | |
| SCHEMBL6607580 | 0.84 | HTR1B (0.47) | HTR1BHTR1DHTR1ANOTUMGHSR | |
| SCHEMBL6607581 | 0.84 | HTR1B (0.47) | HTR1BHTR1DHTR1ANOTUMGHSR |
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-1216239-A1 | PIPERAZINE DERIVATIVES AS 5-HT1B ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 2002-06-26 | — | — | EP | disclosed |
| WO-2001023374-A1 | PIPERAZINE DERIVATIVES AS 5-HT1B ANTAGONISTS | SMITHKLINE BEECHAM P.L.C. (GB) | 2001-04-05 | — | — | WO | disclosed |