Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 3/20 | 0.35 |
| ▸ | PPARA | Q07869 | 2/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 6/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 6/20 | 0.34 |
| ▸ | MAOB | P27338 | 3/20 | 0.33 |
| ▸ | ALB | P02768 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22703003 | 0.93 | ITGB3 (0.38) | S1PR1PPARDPPARAFFAR1PPARG | |
| SCHEMBL22683260 | 0.81 | ITGB3 (0.43) | S1PR1PPARDPPARAFFAR1PPARG | |
| SCHEMBL20031911 | 0.80 | MAOB (0.41) | PPARDPPARAITGB3ITGA2BMAOB | |
| SCHEMBL20031904 | 0.77 | THRA (0.43) | MAOBEGFR | |
| SCHEMBL20031873 | 0.77 | MAOB (0.38) | PPARDPPARAITGB3ITGA2BMAOB | |
| SCHEMBL22683257 | 0.77 | MAOB (0.39) | PPARDPPARAITGB3ITGA2BMAOB | |
| SCHEMBL20031639 | 0.77 | ALB (0.44) | S1PR1PPARDPPARAITGB3ITGA2B | |
| SCHEMBL20031909 | 0.76 | MAOB (0.43) | PPARDPPARAMAOBEGFR | |
| SCHEMBL20031890 | 0.76 | MAOB (0.38) | MAOBEGFR | |
| SCHEMBL20031650 | 0.76 | MAOB (0.38) | PPARDPPARAMAOBEGFR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018063105-A1 | [5]HELICENE DERIVATIVES AS MOLECULAR REPORTERS FOR DIAGNOSTIC APPLICATIONS AND METHODS OF SYNTHESIS THEREFOR | NATIONAL SCIENCE AND TECHNOLOGY DEVELOPMENT AGENCY (TH) | 2018-04-05 | — | — | WO | disclosed |