Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 13/20 | 0.72 |
| ▸ | ITGA2B | P08514 | 13/20 | 0.72 |
| ▸ | MAOA | P21397 | 2/20 | 0.57 |
| ▸ | MAOB | P27338 | 2/20 | 0.57 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4419593 | 0.84 | ITGB3 (0.72) | ITGB3ITGA2BMAOAMAOBHRH3 | |
| SCHEMBL4416062 | 0.82 | ITGB3 (0.66) | ITGB3ITGA2BMAOAMAOBAOC3 | |
| SCHEMBL4420448 | 0.80 | ITGB3 (0.68) | ITGB3ITGA2BMAOAMAOBAOC3 | |
| SCHEMBL4552785 | 0.80 | ITGB3 (0.56) | ITGB3ITGA2BMAOAMAOB | |
| SCHEMBL4429086 | 0.77 | ITGB3 (0.56) | ITGB3ITGA2BMAOAMAOB | |
| SCHEMBL5617536 | 0.77 | ITGB3 (0.63) | ITGB3ITGA2BMAOAMAOB | |
| SCHEMBL8043511 | 0.77 | ITGB3 (0.61) | ITGB3ITGA2BMAOAMAOBAOC3 | |
| SCHEMBL17200568 | 0.76 | HRH3 (0.61) | HRH3 | |
| SCHEMBL4419498 | 0.76 | MAOB (0.53) | ITGB3ITGA2BMAOAMAOB | |
| SCHEMBL29798701 | 0.75 | ITGB3 (0.60) | ITGB3ITGA2BMAOAMAOBAOC3 |
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-1501804-A1 | ISOQUINOLINE DERIVATIVES MAO-B INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-02-02 | — | — | EP | disclosed |
| WO-2003091219-A1 | ISOQUINOLINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-11-06 | — | — | WO | disclosed |