Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 7/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ARHGDIA | P52565 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6180405 | 0.98 | MTNR1A (0.47) | MTNR1AMTNR1BBRD4ROCK2ARHGDIA | |
| Hydrochloric Acid SCHEMBL6708207 | 0.96 | MTNR1A (0.46) | MTNR1AMTNR1BBRD4ROCK2ARHGDIA | |
| SCHEMBL5833927 | 0.79 | ROCK2 (0.43) | ROCK2ARHGDIAROCK1MAPT | |
| SCHEMBL5833283 | 0.76 | GBA1 (0.46) | ROCK2ARHGDIAROCK1MAPT | |
| SCHEMBL6545036 | 0.76 | ROCK2 (0.43) | ROCK2ARHGDIAROCK1MAPTALDH1A1 | |
| SCHEMBL5832943 | 0.76 | ALPL (0.54) | ACHE | |
| SCHEMBL5833530 | 0.75 | MAPK1 (0.44) | ALDH1A1 | |
| SCHEMBL6707469 | 0.75 | DRD2 (0.47) | ROCK2ARHGDIAROCK1MAPT | |
| Hydrochloric Acid SCHEMBL6709626 | 0.75 | ROCK2 (0.43) | ROCK2ARHGDIAROCK1MAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL6709625 | 0.74 | DRD2 (0.46) | ROCK2ARHGDIAROCK1MAPT |
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-1379502-A1 | NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS | MERCK PATENT GmbH (DE) | 2004-01-14 | — | — | EP | disclosed |
| WO-2002083640-A1 | NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS | MERCK PATENT GMBH (DE) | 2002-10-24 | — | — | WO | disclosed |