Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.32 |
| ▸ | TAS2R46 | P59540 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17634349 | 1.00 | PTPN1 (0.42) | PTPN1CES2OPRM1ACE2TAS2R46 | |
| SCHEMBL13770796 | 0.84 | CES2 (0.34) | PTPN1CES2TAS2R46 | |
| SCHEMBL13770897 | 0.84 | CES2 (0.39) | PTPN1CES2 | |
| SCHEMBL13770791 | 0.84 | CES2 (0.39) | PTPN1CES2 | |
| SCHEMBL12641992 | 0.84 | CES2 (0.39) | PTPN1CES2 | |
| SCHEMBL12641991 | 0.84 | CES2 (0.34) | PTPN1CES2TAS2R46 | |
| SCHEMBL29488559 | 0.84 | CES2 (0.34) | PTPN1CES2TAS2R46 | |
| SCHEMBL13771155 | 0.82 | CES2 (0.40) | CES2TAS2R46 | |
| SCHEMBL13770795 | 0.82 | CES2 (0.40) | CES2TAS2R46 | |
| Hydrogen Peroxide SCHEMBL5076367 | 0.82 | CES2 (0.40) | CES2TAS2R46 |
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-2004112819-A1 | COMPOSITIONS AND METHODS OF TREATMENT COMPRISING PLANT EXTRACTS | GELSTAT CORPORATION (US) | 2004-12-29 | — | — | WO | disclosed |