Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 14/20 | 0.47 |
| ▸ | HTR1D | P28221 | 7/20 | 0.47 |
| ▸ | HTR1B | P28222 | 7/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 9/20 | 0.45 |
| ▸ | HTR2A | P28223 | 8/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 4/20 | 0.43 |
| ▸ | DRD3 | P35462 | 4/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 3/20 | 0.43 |
| ▸ | HTR2B | P41595 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8546121 | 1.00 | HTR1A (0.47) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL8546868 | 0.99 | HTR1A (0.47) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL8546871 | 0.99 | HTR1A (0.47) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL8550861 | 0.85 | HTR1A (0.49) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL6017220 | 0.85 | HTR1A (0.49) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL8550906 | 0.84 | HTR1A (0.48) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL8550912 | 0.84 | HTR1A (0.48) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 | |
| SCHEMBL8545047 | 0.83 | HTR1A (0.53) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL8545546 | 0.82 | HTR1A (0.52) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 | |
| SCHEMBL8543468 | 0.81 | HTR1A (0.48) | HTR1AHTR1DHTR1BSLC6A4CYP2C9 |
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-0660832-B1 | SEROTONIN RECEPTOR AGENTS | MERRELL PHARMA INC (US) | 1998-01-14 | — | — | EP | disclosed |
| US-5436246-A | Compounds for treatment of anxiety, depression, migraine, stroke, angina and hypertension | MERRELL DOW PHARMACEUTICALS INC. | 1995-07-25 | — | — | US | disclosed |