Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | ANPEP | P15144 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ADH1B | P00325 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
| ▸ | SCN1A | P35498 | 1/20 | 0.31 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.31 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.30 |
| ▸ | MMP8 | P22894 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4525404 | 0.86 | CYP2C19 (0.37) | HRH4HRH3CYP2C19CYP2D6ALDH1A1 | |
| SCHEMBL26929194 | 0.83 | ANPEP (0.33) | ANPEP | |
| SCHEMBL9624660 | 0.77 | HRH4 (0.47) | HRH4HRH3CYP2C19CYP2D6ALDH1A1 | |
| SCHEMBL2478778 | 0.77 | HRH4 (0.42) | HRH4HRH3CYP2C19CYP2D6ALDH1A1 | |
| SCHEMBL24379824 | 0.75 | HRH4 (0.48) | HRH4HRH3CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL10045260 | 0.75 | CYP2C19 (0.45) | HRH4HRH3CYP2C19CYP2D6ALDH1A1 | |
| SCHEMBL5298781 | 0.75 | HRH4 (0.48) | HRH4HRH3CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL2483497 | 0.75 | HRH4 (0.48) | HRH4HRH3CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL20801306 | 0.74 | PKM (0.33) | ALDH1A1PKM | |
| SCHEMBL271862 | 0.74 | HRH4 (0.37) | HRH4HRH3CYP2C19ALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7507480-B2 | Corrosion-resistant metal surfaces | BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) | 2009-03-24 | — | — | US | disclosed |
| US-20060269760-A1 | Corrosion-resistant metal surfaces | ENERGY, UNITED STATES DEPARTMENT OF | 2006-11-30 | — | — | US | disclosed |