Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 7/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | ILK | Q13418 | 1/20 | 0.57 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL229456 | 0.86 | APP (0.68) | APPCYP1A2CYP3A4CYP2C19ILK | |
| SCHEMBL142037 | 0.82 | APP (0.59) | APPCYP1A2CYP3A4CYP2C19ILK | |
| SCHEMBL28798406 | 0.81 | APP (0.61) | APPCYP1A2CYP3A4CYP2C19ILK | |
| SCHEMBL28801433 | 0.81 | APP (0.64) | APPCYP1A2CYP3A4CYP2C19ILK | |
| SCHEMBL1982972 | 0.80 | APP (0.67) | APPCYP1A2CYP3A4CYP2C19ILK | |
| SCHEMBL4730485 | 0.79 | APP (0.66) | APPCYP1A2CYP3A4CYP2C19ILK | |
| SCHEMBL1754405 | 0.77 | APP (0.71) | APPCYP1A2CYP3A4CYP2C19GLA | |
| SCHEMBL17553302 | 0.77 | APP (0.60) | APPCYP1A2CYP3A4CYP2C19ILK | |
| Hydrochloric Acid SCHEMBL17541564 | 0.76 | APP (0.59) | APPCYP1A2CYP3A4CYP2C19ILK | |
| SCHEMBL6982071 | 0.76 | APP (0.66) | APPCYP1A2CYP3A4CYP2C19ILK |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012035055-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-22 | — | — | WO | disclosed |