Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | CYP46A1 | Q9Y6A2 | 3/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.32 |
| ▸ | CPB2 | Q96IY4 | 8/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 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 | |
|---|---|---|---|---|
| SCHEMBL27559418 | 0.84 | TDO2 (0.40) | TDO2CYP46A1GRM2PIK3CAPIK3CG | |
| SCHEMBL7740471 | 0.83 | ITGA4 (0.36) | — | |
| SCHEMBL7734182 | 0.83 | GRM2 (0.33) | CYP46A1GRM2PIK3CAPIK3CGNTRK1 | |
| SCHEMBL6682105 | 0.78 | PRKCI (0.37) | GRM2NR1H2 | |
| SCHEMBL12569696 | 0.77 | PRKCI (0.38) | GRM2NR1H2 | |
| SCHEMBL6681898 | 0.77 | MAPT (0.47) | NR1H2 | |
| SCHEMBL7246662 | 0.76 | GAA (0.36) | GRM2NR1H2 | |
| SCHEMBL6680044 | 0.76 | HTT (0.48) | NR1H2 | |
| SCHEMBL6674369 | 0.76 | PRKCI (0.41) | GRM2NR1H2 | |
| SCHEMBL24891920 | 0.75 | GRM2 (0.36) | GRM2NR1H2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6414005-B1 | BRAIN DISORDERS; ALZHEIMER'S DISEASE; PARKINSON'S DISEASE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2002-07-02 | — | — | US | disclosed |
| EP-1043312-A1 | HETEROCYCLIC COMPOUNDS HAVING NOS INHIBITORY ACTIVITIES | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2000-10-11 | — | — | EP | disclosed |