Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | DRD2 | P14416 | 2/20 | 0.60 |
| ▸ | HTR2A | P28223 | 2/20 | 0.60 |
| ▸ | HTR2C | P28335 | 2/20 | 0.60 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.60 |
| ▸ | HRH1 | P35367 | 2/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.60 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.60 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.60 |
| ▸ | CNR1 | P21554 | 1/20 | 0.60 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.60 |
| ▸ | HTR7 | P34969 | 1/20 | 0.60 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.60 |
| ▸ | DRD3 | P35462 | 1/20 | 0.60 |
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 SCHEMBL9287779 | 0.99 | HTR1A (0.63) | HTR1AALDH1A1DRD2HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL11078746 | 0.98 | HTR1A (0.62) | HTR1AALDH1A1DRD2HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL11078726 | 0.98 | HTR1A (0.62) | HTR1AALDH1A1DRD2HTR2AHTR2C | |
| Tiospirone SCHEMBL78696 | 0.82 | — | — | |
| Tiospirone SCHEMBL29356145 | 0.82 | — | — | |
| SCHEMBL13532488 | 0.82 | — | — | |
| Tiospirone SCHEMBL122406 | 0.82 | — | — | |
| Tiospirone SCHEMBL11081111 | 0.81 | — | — | |
| SCHEMBL10469615 | 0.79 | HTR1A (0.61) | HTR1AALDH1A1DRD2HTR2AHTR2C | |
| SCHEMBL9376454 | 0.78 | HTR1A (0.52) | HTR1ADRD2HTR2AHTR7DRD3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4411901-A | ANTIPSYCHOTICS | MEAD JOHNSON & COMPANY (US) | 1983-10-25 | — | — | US | claimed |
| EP-2083811-A1 | METHODS OF TREATING MENTAL RETARDATION, DOWN'S SYNDROME, FRAGILE X SYNDROME AND AUTISM | Seaside Therapeutics, LLC (US) | 2009-08-05 | — | — | EP | disclosed |
| WO-2008066750-A1 | METHODS OF TREATING MENTAL RETARDATION, DOWN'S SYNDROME, FRAGILE X SYNDROME AND AUTISM | SEASIDE THERAPEUTICS, LLC (US) | 2008-06-05 | — | — | WO | disclosed |
| US-4452799-A | NEUROLEPTIC AGENTS | MEAD JOHNSON & COMPANY (US) | 1984-06-05 | — | — | US | disclosed |
| US-4411901-A | ANTIPSYCHOTICS | MEAD JOHNSON & COMPANY (US) | 1983-10-25 | — | — | US | disclosed |