Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8703577 | 1.00 | OPRD1 (0.44) | OPRD1PTGESALOX5TRPA1USP2 | |
| SCHEMBL8702629 | 0.86 | PTPN1 (0.40) | TRPA1USP2CYP3A4SMN1; SMN2ERN1 | |
| SCHEMBL8702040 | 0.86 | PTPN1 (0.40) | TRPA1USP2CYP3A4SMN1; SMN2ERN1 | |
| SCHEMBL8699343 | 0.84 | ALOX5 (0.50) | OPRD1PTGESALOX5USP2CYP3A4 | |
| SCHEMBL8704552 | 0.81 | ALDH1A1 (0.39) | PTGESALOX5TRPA1CYP3A4PPARG | |
| SCHEMBL8697581 | 0.81 | TRPA1 (0.47) | ALOX5TRPA1CYP3A4MAPK1SMN1; SMN2 | |
| SCHEMBL8704284 | 0.81 | TRPA1 (0.47) | ALOX5TRPA1CYP3A4MAPK1SMN1; SMN2 | |
| SCHEMBL8698398 | 0.81 | TRPA1 (0.47) | ALOX5TRPA1CYP3A4MAPK1SMN1; SMN2 | |
| SCHEMBL8698613 | 0.80 | PTGS2 (0.42) | OPRD1USP2CYP3A4MAPK1SMN1; SMN2 | |
| SCHEMBL8698457 | 0.80 | PTGS2 (0.42) | OPRD1USP2CYP3A4MAPK1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998008837-A1 | PHENYLBUTANOL DERIVATIVES, METHODS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF | FARMACON, INC. (US) | 1998-03-05 | — | — | WO | claimed |
| WO-1998008837-A1 | PHENYLBUTANOL DERIVATIVES, METHODS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF | FARMACON, INC. (US) | 1998-03-05 | — | — | WO | disclosed |