Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 13/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 13/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.41 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4429086 | 0.79 | ITGB3 (0.56) | ITGB3ITGA2B | |
| SCHEMBL4427021 | 0.77 | SCN3A (0.52) | ITGB3ITGA2BAOC3 | |
| SCHEMBL4563539 | 0.77 | SCN3A (0.52) | ITGB3ITGA2BAOC3 | |
| SCHEMBL3507011 | 0.76 | ITGB3 (0.49) | ITGB3ITGA2BAOC3 | |
| SCHEMBL3507015 | 0.76 | ITGB3 (0.49) | ITGB3ITGA2BAOC3 | |
| SCHEMBL6681755 | 0.76 | BCAT2 (0.50) | THRB | |
| SCHEMBL4418172 | 0.75 | ITGB3 (0.41) | ITGB3ITGA2BPRMT5WDR77 | |
| SCHEMBL4415993 | 0.75 | ITGB3 (0.41) | ITGB3ITGA2BPRMT5WDR77 | |
| SCHEMBL4415995 | 0.75 | ITGB3 (0.41) | ITGB3ITGA2BPRMT5WDR77 | |
| SCHEMBL4420034 | 0.75 | ITGB3 (0.54) | ITGB3ITGA2B |
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-B1 | ISOQUINOLINE DERIVATIVES MAO-B INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-08-26 | — | — | EP | disclosed |
| US-6818774-B2 | 2-(S)-(6-(4-FLUORO-BENZYLOXY)-3-OXO-3,4-DIHYDRO-1H-ISOQUINOLIN -2-YL)- PROPIONAMIDE FOR EXAMPLE; ALZHEIMER'S DISEASE OR SENILE DEMENTIA | HOFFMAN-LA ROCHE INC. | 2004-11-16 | — | — | US | disclosed |