Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.30 |
| ▸ | GABRA3 | P34903 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2655667 | 0.85 | GABRA1 (0.41) | LRRK2GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL2656330 | 0.80 | GABRA1 (0.47) | LRRK2HSD11B1GABRA1GABRG2GABRB3 | |
| SCHEMBL2654714 | 0.79 | GABRA1 (0.40) | LRRK2HSD11B1GABRA1GABRG2GABRB3 | |
| SCHEMBL7002743 | 0.79 | GABRG2 (0.51) | LRRK2GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL6999735 | 0.79 | GABRA1 (0.47) | LRRK2HSD11B1GABRA1GABRG2GABRB3 | |
| SCHEMBL2655353 | 0.75 | GABRA1 (0.45) | LRRK2GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL7003425 | 0.71 | LRRK2 (0.32) | LRRK2 | |
| SCHEMBL2656880 | 0.70 | GABRA1 (0.37) | GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL7003302 | 0.69 | GABRA1 (0.42) | GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL7003307 | 0.68 | — | — |
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-1107967-B1 | TRIAZOLOPYRIDAZINE DERIVATIVES FOR ENHANCING COGNITION | MERCK SHARP & DOHME (GB) | 2003-05-14 | — | — | EP | claimed |