Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.31 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.31 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | S1PR1 | P21453 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3463052 | 0.91 | CYP2D6 (0.33) | HSP90AA1HSP90AB1S1PR1 | |
| SCHEMBL2474054 | 0.88 | ALOX5AP (0.31) | — | |
| SCHEMBL2473825 | 0.85 | RARB (0.38) | HDAC4S1PR1 | |
| SCHEMBL3462797 | 0.85 | S1PR1 (0.38) | S1PR1 | |
| SCHEMBL2472183 | 0.83 | OPRM1 (0.36) | S1PR1 | |
| SCHEMBL3462877 | 0.82 | S1PR1 (0.36) | HSP90AA1HSP90AB1S1PR1 | |
| SCHEMBL2527579 | 0.80 | HDAC4 (0.30) | HDAC4 | |
| SCHEMBL2474605 | 0.78 | RARB (0.45) | HDAC4S1PR1 | |
| SCHEMBL2474311 | 0.77 | NPC1 (0.39) | HSP90AA1HSP90AB1HDAC4S1PR1 | |
| SCHEMBL2476261 | 0.76 | RARB (0.37) | HDAC4S1PR1 |
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-2010072352-A1 | 1, 2, 4 -OXADIAZOLE DERIVATIVES AND THEIR THERAPEUTIC USE | ALMIRALL S.A. (ES) | 2010-07-01 | — | — | WO | claimed |