Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 16/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18091999 | 0.92 | GABRA5 (0.49) | GABRA5ALDH1A1HDAC3HDAC1HDAC6 | |
| SCHEMBL18091969 | 0.87 | GABRA5 (0.51) | GABRA5ALDH1A1 | |
| SCHEMBL286136 | 0.85 | GABRA5 (0.52) | GABRA5ALDH1A1 | |
| SCHEMBL18091967 | 0.85 | KMT2A (0.44) | GABRA5ALDH1A1 | |
| SCHEMBL18092016 | 0.84 | GABRA5 (0.49) | GABRA5ALDH1A1 | |
| SCHEMBL18092036 | 0.84 | GABRA5 (0.53) | GABRA5 | |
| SCHEMBL18091997 | 0.82 | GABRA5 (0.46) | GABRA5 | |
| SCHEMBL18092045 | 0.82 | GABRA5 (0.55) | GABRA5 | |
| SCHEMBL18092005 | 0.82 | GABRA5 (0.54) | GABRA5 | |
| SCHEMBL18092038 | 0.82 | GABRA5 (0.54) | GABRA5 |
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-B1 | ISOXAZOLE-THIAZOLE DERIVATIVES AS GABA A RECEPTOR INVERSE AGONISTS FOR USE IN THE TREATMENT OF COGNITIVE DISORDERS | HOFFMANN LA ROCHE (CH) | 2016-09-28 | — | — | EP | claimed |