Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 7/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 7/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7300949 | 1.00 | ITGB3 (0.41) | ITGB3ITGA2BHRH3HRH4L3MBTL1 | |
| SCHEMBL7330192 | 0.90 | ITGB3 (0.41) | ITGB3ITGA2BACEACE2ITGB1 | |
| SCHEMBL3862102 | 0.87 | ITGB3 (0.40) | ITGB3ITGA2BMAPK1SMN1; SMN2 | |
| SCHEMBL3862108 | 0.87 | ITGB3 (0.40) | ITGB3ITGA2BMAPK1SMN1; SMN2 | |
| SCHEMBL14135398 | 0.85 | ITGB3 (0.38) | ITGB3ITGA2BHRH3 | |
| SCHEMBL4652297 | 0.83 | ITGB3 (0.45) | ITGB3ITGA2B | |
| SCHEMBL4653394 | 0.83 | ITGB3 (0.45) | ITGB3ITGA2B | |
| SCHEMBL4654556 | 0.83 | ITGB3 (0.45) | ITGB3ITGA2B | |
| SCHEMBL753950 | 0.83 | ITGA4 (0.41) | ITGB3ITGA2BACEITGA4 | |
| SCHEMBL13396568 | 0.83 | ITGB3 (0.37) | ITGB3ITGA2B |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116082565-A | Self-assembled oxidation mimic enzyme material and preparation method and application thereof | 北京化工大学 | 2023-05-09 | — | — | CN | claimed |
| CN-116082565-A | Self-assembled oxidation mimic enzyme material and preparation method and application thereof | 北京化工大学 | 2023-05-09 | — | — | CN | disclosed |
| CN-108164506-A | A kind of DPP-4 enzyme inhibitors and its preparation and application | 上海交通大学 | 2018-06-15 | — | — | CN | disclosed |
| EP-0729472-A4 | PIPERIDINYLCAMPHORSULFONYL OXYTOCIN ANTAGONISTS | MERCK & CO INC (US) | 1997-03-19 | — | — | EP | disclosed |
| EP-0729472-A1 | PIPERIDINYLCAMPHORSULFONYL OXYTOCIN ANTAGONISTS | MERCK & CO. INC. (US) | 1996-09-04 | — | — | EP | disclosed |
| WO-1995014025-A1 | PIPERIDINYLCAMPHORSULFONYL OXYTOCIN ANTAGONISTS | MERCK & CO., INC. (US) | 1995-05-26 | — | — | WO | disclosed |
| EP-0486280-A2 | Piperidinylcamphorsulfonyl oxytocin antagonists | MERCK & CO. INC. (US) | 1992-05-20 | — | — | EP | disclosed |