Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 20/20 | 0.68 |
| ▸ | HTR1B | P28222 | 20/20 | 0.68 |
| ▸ | HTR2A | P28223 | 1/20 | 0.59 |
| ▸ | HTR2C | P28335 | 1/20 | 0.59 |
| ▸ | HTR1F | P30939 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL8145296 | 1.00 | HTR1D (0.68) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL8145293 | 1.00 | HTR1D (0.68) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL8143248 | 0.87 | HTR1D (0.69) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL8143246 | 0.87 | HTR1D (0.69) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL8143245 | 0.87 | HTR1D (0.69) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL8137448 | 0.87 | HTR1D (0.67) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL8143649 | 0.87 | HTR1D (0.67) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL8143646 | 0.87 | HTR1D (0.67) | HTR1DHTR1BHTR2AHTR2CHTR1F | |
| SCHEMBL8816366 | 0.82 | ACHE (0.45) | HTR1DHTR1B | |
| SCHEMBL8816361 | 0.82 | ACHE (0.45) | HTR1DHTR1B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6054456-A | Substituted piperazine derivatives | MERCK SHARP & DOHME LTD. (GB) | 2000-04-25 | — | — | US | claimed |
| US-6054456-A | Substituted piperazine derivatives | MERCK SHARP & DOHME LTD. (GB) | 2000-04-25 | — | — | US | disclosed |
| WO-1997019943-A1 | SUBSTITUTED PIPERAZINE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1997-06-05 | — | — | WO | disclosed |