Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5718317 | 0.95 | SLC6A2 (0.49) | PTGS2SLC6A2SLC6A4SLC6A3OPRM1 | |
| Hydrochloric Acid SCHEMBL5701112 | 0.93 | SLC6A2 (0.47) | PTGS2SLC6A2SLC6A4SLC6A3OPRM1 | |
| SCHEMBL19494132 | 0.89 | OPRM1 (0.47) | OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL17086664 | 0.89 | OPRM1 (0.47) | OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL17086651 | 0.89 | OPRM1 (0.47) | OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL17086655 | 0.85 | OPRM1 (0.47) | SLC6A2SLC6A4OPRM1OPRD1OPRK1 | |
| SCHEMBL17086666 | 0.85 | OPRM1 (0.47) | SLC6A2SLC6A4OPRM1OPRD1OPRK1 | |
| SCHEMBL9717862 | 0.83 | OPRM1 (0.46) | SLC6A2SLC6A4SLC6A3OPRM1OPRD1 | |
| SCHEMBL8124662 | 0.83 | OPRM1 (0.46) | SLC6A2SLC6A4SLC6A3OPRM1OPRD1 | |
| SCHEMBL17086663 | 0.81 | OPRM1 (0.50) | OPRM1OPRD1OPRK1OPRL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1687288-A1 | SUBSTITUTED ARYL CYCLOALKANOL DERIVATIVES AND METHODS OF THEIR USE | Wyeth (US) | 2006-08-09 | — | — | EP | claimed |
| WO-2005037809-A1 | SUBSTITUTED ARYL CYCLOALKANOL DERIVATIVES AND METHODS OF THEIR USE | WYETH (US) | 2005-04-28 | — | — | WO | claimed |
| EP-1673059-A2 | ALKANOL AND CYCLOALKANOL-AMINE DERIVATIVES AND METHODS OF THEIR USE | Wyeth (US) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005037207-A2 | ARYLALKYL-PIPERAZINE DERIVATIVES FOR THE TREATMENT OF CONDITIONS AMELIORATED BY MONOAMINE REUPTAKE INCLUDING VASOMOTOR SYMPTOMS (VMS) | WYETH (US) | 2005-04-28 | — | — | WO | disclosed |