Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 7/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 7/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.38 |
| ▸ | ALB | P02768 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 3/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20031905 | 0.93 | S1PR1 (0.37) | ITGB3ITGA2BS1PR1ALBPPARD | |
| SCHEMBL22683260 | 0.87 | ITGB3 (0.43) | ITGB3ITGA2BS1PR1ALBPPARD | |
| SCHEMBL20031911 | 0.86 | MAOB (0.41) | ITGB3ITGA2BPPARDPPARAMAOB | |
| SCHEMBL22683257 | 0.82 | MAOB (0.39) | ITGB3ITGA2BPPARDPPARAMAOB | |
| SCHEMBL20031639 | 0.82 | ALB (0.44) | ITGB3ITGA2BS1PR1ALBPPARD | |
| SCHEMBL20031909 | 0.82 | MAOB (0.43) | PPARDPPARAMAOBEGFR | |
| SCHEMBL20031890 | 0.81 | MAOB (0.38) | MAOBEGFR | |
| SCHEMBL20031650 | 0.81 | MAOB (0.38) | PPARDPPARAMAOBEGFR | |
| SCHEMBL20031904 | 0.81 | THRA (0.43) | MAOBEGFR | |
| SCHEMBL22683275 | 0.79 | ITGB3 (0.38) | ITGB3ITGA2BS1PR1ALBPPARD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3518746-B1 | [5]HELICENE DERIVATIVES AS MOLECULAR REPORTERS FOR DIAGNOSTIC APPLICATIONS AND METHODS OF SYNTHESIS THEREFOR | NATIONAL SCIENCE AND TECH DEVELOPMENT AGENCY (TH) | 2020-11-25 | — | — | EP | disclosed |