Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.51 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.51 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 2/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4622244 | 0.85 | ITGB3 (0.68) | ITGB3ITGA2BCYP26A1FFAR1FAAH | |
| SCHEMBL4621845 | 0.84 | BACE1 (0.60) | ITGB3ITGA2BCYP26A1FFAR1FAAH | |
| SCHEMBL2302634 | 0.82 | CYP19A1 (0.51) | ITGB3ITGA2BCYP26A1 | |
| SCHEMBL7349921 | 0.82 | ITGB3 (0.58) | ITGB3ITGA2BCYP26A1FFAR1FAAH | |
| SCHEMBL7347857 | 0.82 | ITGB3 (0.64) | ITGB3ITGA2BCYP26A1FFAR1FAAH | |
| SCHEMBL4622642 | 0.79 | BACE1 (0.54) | ITGB3ITGA2BCYP26A1FFAR1FAAH | |
| SCHEMBL7297164 | 0.78 | CYP19A1 (0.51) | ITGB3ITGA2BCYP26A1 | |
| SCHEMBL14440080 | 0.78 | MCHR1 (0.53) | ITGB3ITGA2BCYP26A1FFAR1BACE1 | |
| SCHEMBL7346629 | 0.77 | BACE1 (0.52) | ITGB3ITGA2BCYP26A1FFAR1FAAH | |
| Hydrochloric Acid SCHEMBL4622314 | 0.77 | MCHR1 (0.52) | ITGB3ITGA2BCYP26A1FFAR1BACE1 |
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-0971878-A1 | AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2000-01-19 | — | — | EP | disclosed |
| WO-1998038156-A1 | AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-03 | — | — | WO | disclosed |