Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 20/20 | 0.64 |
| ▸ | HTR1B | P28222 | 20/20 | 0.64 |
| ▸ | HTR1A | P08908 | 1/20 | 0.62 |
| ▸ | HTR2A | P28223 | 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 | |
|---|---|---|---|---|
| SCHEMBL8560481 | 0.86 | HTR1D (0.65) | HTR1DHTR1BHTR1AHTR2A | |
| SCHEMBL8565568 | 0.85 | HTR1D (0.65) | HTR1DHTR1B | |
| SCHEMBL8564514 | 0.81 | HTR1D (0.57) | HTR1DHTR1BHTR1AHTR2A | |
| SCHEMBL4579265 | 0.80 | HTR1D (0.84) | HTR1DHTR1BHTR1AHTR2A | |
| SCHEMBL8560627 | 0.78 | HTR1D (0.73) | HTR1DHTR1B | |
| SCHEMBL4340068 | 0.78 | HTR1D (1.00) | HTR1DHTR1BHTR1AHTR2A | |
| SCHEMBL4352154 | 0.78 | HTR1D (1.00) | HTR1DHTR1B | |
| SCHEMBL8647372 | 0.78 | HTR1D (0.79) | HTR1DHTR1BHTR1AHTR2A | |
| SCHEMBL8647369 | 0.78 | HTR1D (0.79) | HTR1DHTR1BHTR1AHTR2A | |
| SCHEMBL8560678 | 0.77 | HTR1D (0.74) | HTR1DHTR1BHTR1AHTR2A |
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-5849746-A | Substituted 1,4-piperazine-heteroaryl derivatives as 5-HT1D receptor agonists | MERCK SHARP & DOHME LTD. (GB) | 1998-12-15 | — | — | US | disclosed |
| EP-0807109-A1 | SUBSTITUTED 1,4-PIPERAZINE-HETEROARYL DERIVATIVES AS 5-HT 1D? RECEPTOR AGONISTS | MERCK SHARP & DOHME LTD. (GB) | 1997-11-19 | — | — | EP | disclosed |
| WO-1996023785-A1 | SUBSTITUTED 1,4-PIPERAZINE-HETEROARYL DERIVATIVES AS 5-HT1D RECEPTOR AGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1996-08-08 | — | — | WO | disclosed |