Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 15/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18092042 | 0.88 | GABRA5 (0.41) | GABRA5ACACB | |
| SCHEMBL18092074 | 0.88 | GABRA5 (0.37) | GABRA5 | |
| SCHEMBL286211 | 0.86 | GABRA5 (0.41) | GABRA5ARCYP2C9MAPK11MAPK14 | |
| SCHEMBL286210 | 0.86 | GABRA5 (0.41) | GABRA5ARCYP2C9MAPK11MAPK14 | |
| SCHEMBL18092039 | 0.85 | GABRA5 (0.43) | GABRA5 | |
| SCHEMBL18092027 | 0.78 | GABRA5 (0.44) | GABRA5 | |
| SCHEMBL286052 | 0.76 | GABRA5 (0.51) | GABRA5CYP2C9MAPK14 | |
| SCHEMBL286053 | 0.76 | GABRA5 (0.51) | GABRA5CYP2C9MAPK14 | |
| SCHEMBL18092061 | 0.75 | GABRA5 (0.38) | GABRA5 | |
| SCHEMBL18092015 | 0.75 | GABRA5 (0.42) | 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 |