Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 1/20 | 0.39 |
| ▸ | GABRD | O14764 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.39 |
| ▸ | GABRE | P78334 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.39 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL223962 | 0.88 | EPHX1 (0.47) | CES2CES1TSHREPHX1RECQL | |
| SCHEMBL4265799 | 0.87 | RECQL (0.42) | CES2CES1TSHRRECQLGABRP | |
| SCHEMBL15343955 | 0.86 | CES2 (0.44) | CES2CES1TSHREPHX1RECQL | |
| SCHEMBL31733905 | 0.86 | CES2 (0.48) | CES2CES1TSHREPHX1RECQL | |
| SCHEMBL16062725 | 0.86 | CES2 (0.48) | CES2CES1TSHREPHX1RECQL | |
| SCHEMBL29221503 | 0.84 | EPHX1 (0.42) | CES2CES1TSHREPHX1RECQL | |
| SCHEMBL13457435 | 0.83 | TSHR (0.44) | CES2CES1TSHREPHX1RECQL | |
| Cyclohexane SCHEMBL28236664 | 0.83 | CES2 (0.55) | CES2CES1TSHRRECQLGABRP | |
| SCHEMBL25212375 | 0.83 | CES2 (0.61) | CES2CES1TSHREPHX1RECQL | |
| SCHEMBL242069 | 0.83 | CES2 (0.61) | CES2CES1TSHREPHX1RECQL |
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-1496911-B1 | USE OF A COMBINATION COMPRISING A2A ADENOSINE RECEPTOR AGONISTS AND ANTI-PATHOGENIC AGENTS FOR THE TREATMENT OF INFLAMMATORY DISEASES | UNIV VIRGINIA (US) | 2007-12-19 | — | — | EP | claimed |