Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 11/20 | 0.39 |
| ▸ | RXRA | P19793 | 3/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2687727 | 0.85 | GRM5 (0.42) | GRM5GABRA5FLT3 | |
| SCHEMBL2687571 | 0.82 | GABRA5 (0.59) | GABRA5 | |
| SCHEMBL16104531 | 0.79 | GABRA5 (0.52) | GABRA5 | |
| SCHEMBL6370913 | 0.78 | GABRA5 (0.49) | GABRA5 | |
| SCHEMBL2689121 | 0.77 | GABRA5 (0.45) | GRM5GABRA5 | |
| SCHEMBL2687932 | 0.77 | GABRA5 (0.63) | GABRA5 | |
| SCHEMBL4562049 | 0.77 | GRM5 (0.40) | GRM5GABRA5RXRAGRIN1GRIN2B | |
| SCHEMBL2688362 | 0.76 | ITGA5 (0.42) | GRM5GABRA5 | |
| SCHEMBL2688688 | 0.75 | GABRA5 (0.51) | GABRA5 | |
| SCHEMBL2688997 | 0.73 | GABRA5 (0.51) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2638029-A1 | TRIAZOLE DERIVATIVES AND THEIR USE FOR NEUROLOGICAL DISORDERS | F.HOFFMANN-LA ROCHE AG (CH) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012062687-A1 | TRIAZOLE DERIVATIVES AND THEIR USE FOR NEUROLOGICAL DISORDERS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-05-18 | — | — | WO | disclosed |