Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 16/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL285740 | 1.00 | CNR1 (0.34) | CNR1GABRA5ALDH1A1HTTGABRA1 | |
| SCHEMBL5535152 | 1.00 | CNR1 (0.34) | CNR1GABRA5ALDH1A1HTTGABRA1 | |
| SCHEMBL286271 | 0.89 | GABRA5 (0.41) | CNR1GABRA5ALDH1A1 | |
| SCHEMBL286272 | 0.89 | GABRA5 (0.41) | CNR1GABRA5ALDH1A1 | |
| SCHEMBL286293 | 0.87 | GABRA5 (0.42) | CNR1GABRA5ALDH1A1 | |
| SCHEMBL286294 | 0.87 | GABRA5 (0.42) | CNR1GABRA5ALDH1A1 | |
| SCHEMBL18091995 | 0.85 | GABRA5 (0.31) | CNR1GABRA5 | |
| SCHEMBL18092055 | 0.85 | GABRA5 (0.31) | CNR1GABRA5 | |
| SCHEMBL285821 | 0.84 | GABRA5 (0.49) | GABRA5ALDH1A1GABRA1 | |
| SCHEMBL285769 | 0.82 | GABRA5 (0.44) | GABRA5GABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2427459-A1 | ISOXAZOLE-THIAZOLE DERIVATIVES AS GABA A RECEPTOR INVERSE AGONISTS FOR USE IN THE TREATMENT OF COGNITIVE DISORDERS | F. Hoffmann-La Roche AG (CH) | 2012-03-14 | — | — | EP | disclosed |