Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 7/20 | 0.50 |
| ▸ | ITGA2B | P08514 | 7/20 | 0.50 |
| ▸ | ACACB | O00763 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14127610 | 0.86 | EPHX2 (0.43) | ITGB3ITGA2BACACBCYP2C9 | |
| SCHEMBL7402061 | 0.80 | HRH3 (0.48) | ITGB3ITGA2BACACBALDH1A1GAA | |
| SCHEMBL29514514 | 0.79 | CYP2C9 (0.59) | ITGB3ITGA2BALDH1A1CYP2D6CYP3A4 | |
| SCHEMBL7398139 | 0.77 | ALDH1A1 (0.49) | ITGB3ITGA2BACACBALDH1A1GAA | |
| SCHEMBL5632393 | 0.76 | NAMPT (0.56) | ACACBHRH3 | |
| SCHEMBL7399368 | 0.74 | FFAR4 (0.46) | ITGB3ITGA2BACACBALDH1A1GAA | |
| SCHEMBL7402064 | 0.74 | ALDH1A1 (0.41) | ITGB3ITGA2BACACBALDH1A1GAA | |
| SCHEMBL7399643 | 0.73 | HRH1 (0.57) | ITGB3ITGA2BACACBHRH3 | |
| SCHEMBL7400365 | 0.72 | ITGB3 (0.48) | ITGB3ITGA2BACACBHRH3 | |
| Trifluoroacetic Acid SCHEMBL3319861 | 0.72 | TSHR (0.55) | ITGB3ITGA2BALDH1A1CYP2D6CYP3A4 |
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-0690847-A1 | HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS | ZENECA LIMITED (GB) | 1996-01-10 | — | — | EP | disclosed |
| WO-1994022835-A2 | HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS | ZENECA LIMITED (GB) | 1994-10-13 | — | — | WO | disclosed |