Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1B | P35368 | 4/20 | 0.60 |
| ▸ | HTR1A | P08908 | 5/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.52 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.52 |
| ▸ | HTR7 | P34969 | 3/20 | 0.51 |
| ▸ | HTR6 | P50406 | 2/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10573066 | 0.98 | ADRA1B (0.62) | ADRA1BHTR1AADRA1AADRA1DHTR7 | |
| SCHEMBL5836414 | 0.91 | ADRA1B (0.55) | ADRA1BHTR1AADRA1AADRA1DHTR7 | |
| Hydrochloric Acid SCHEMBL10574990 | 0.89 | ADRA1B (0.57) | ADRA1BHTR1AADRA1AADRA1DHTR7 | |
| SCHEMBL4910280 | 0.85 | ADRA1B (0.63) | ADRA1BHTR1AADRA1AADRA1DHTR7 | |
| SCHEMBL9536914 | 0.85 | ADRA1B (0.60) | ADRA1BHTR1AADRA1AADRA1DHTR7 | |
| SCHEMBL8146772 | 0.85 | PTGS2 (0.62) | ADRA1BHTR1AADRA1AADRA1DHTR7 | |
| SCHEMBL8151383 | 0.84 | ADRA1B (0.62) | ADRA1BHTR1AADRA1AADRA1DHTR7 | |
| SCHEMBL22125822 | 0.83 | ADRA1B (0.56) | ADRA1BHTR1AADRA1AADRA1DHTR7 | |
| SCHEMBL13321530 | 0.82 | ADRA1B (0.60) | ADRA1BHTR1AADRA1AADRA1DHTR7 | |
| SCHEMBL28739481 | 0.82 | LMNA (0.60) | ADRA1BHTR1AADRA1AADRA1DHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0254623-B1 | AMINOALKYLTHIO TRIAZOLOPYRIDINE OR TRIAZOLOQUINOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, MEDICAMENTS CONTAINING THEM, PARTICULARLY USEFUL AS ANTALGICS | LABORATOIRES UPSA (FR) | 1993-06-09 | — | — | EP | disclosed |
| US-4886805-A | Novel aminoalkylthio derivatives of triazolopyridine or triazoloquinoline, the processes for their preparation, and drugs, useful especially as analgesics, in which they are present | Centre D'Activite Et De Recherches Pharmaceutique Industrielle Biologique Medicale (FR) | 1989-12-12 | — | — | US | disclosed |
| EP-0254623-A1 | Aminoalkylthio triazolopyridine or triazoloquinoline derivatives, process for their preparation, medicaments containing them, particularly useful as antalgics | LABORATOIRES UPSA (FR) | 1988-01-27 | — | — | EP | disclosed |