Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 3/20 | 0.32 |
| ▸ | PPARA | Q07869 | 2/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2327612 | 0.92 | HCRTR1 (0.34) | HCRTR1HCRTR2ADORA2AIKBKBALDH1A1 | |
| SCHEMBL2328104 | 0.92 | HCRTR1 (0.36) | HCRTR1HCRTR2ADORA2APPARGPPARA | |
| SCHEMBL2328920 | 0.87 | IKBKB (0.35) | HCRTR1HCRTR2ADORA2AIKBKBALDH1A1 | |
| SCHEMBL2328930 | 0.85 | HCRTR1 (0.44) | HCRTR1HCRTR2ADORA2AIKBKBALDH1A1 | |
| SCHEMBL2323238 | 0.85 | IKBKB (0.40) | HCRTR1HCRTR2ADORA2APPARGIKBKB | |
| SCHEMBL2327049 | 0.84 | IKBKB (0.48) | ADORA2AIKBKBALDH1A1 | |
| SCHEMBL2331266 | 0.84 | IKBKB (0.45) | HCRTR1HCRTR2ADORA2APPARGIKBKB | |
| SCHEMBL2332690 | 0.84 | NR4A1 (0.37) | HCRTR1HCRTR2ADORA2AIKBKBALDH1A1 | |
| SCHEMBL2327570 | 0.83 | LRRK2 (0.36) | HCRTR1HCRTR2ADORA2APPARGIKBKB | |
| SCHEMBL2327731 | 0.83 | RXRA (0.41) | IKBKBALDH1A1 |
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-2225231-B1 | AMINOTRIAZOLE DERIVATIVES AS ALX AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2011-08-17 | — | — | EP | claimed |
| EP-2225231-B1 | AMINOTRIAZOLE DERIVATIVES AS ALX AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2011-08-17 | — | — | EP | disclosed |