Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.57 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.57 |
| ▸ | APP | P05067 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.57 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.57 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.57 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.57 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.57 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.56 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.56 |
| ▸ | CCR2 | P41597 | 3/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13279749 | 1.00 | AKR1C3 (0.57) | AKR1C3AKR1C2APPCYP3A4CYP2C9 | |
| SCHEMBL301864 | 0.90 | APP (0.66) | AKR1C3AKR1C2APPCYP3A4CYP2C9 | |
| SCHEMBL13279635 | 0.84 | SLC6A4 (0.57) | AKR1C3AKR1C2APPCYP3A4CYP2C9 | |
| SCHEMBL13279470 | 0.84 | SLC6A4 (0.57) | AKR1C3AKR1C2APPCYP3A4CYP2C9 | |
| SCHEMBL13279637 | 0.84 | SLC6A4 (0.57) | AKR1C3AKR1C2APPCYP3A4CYP2C9 | |
| SCHEMBL13279469 | 0.84 | SLC6A4 (0.57) | AKR1C3AKR1C2APPCYP3A4CYP2C9 | |
| SCHEMBL13279752 | 0.84 | SLC6A4 (0.57) | AKR1C3AKR1C2APPCYP3A4CYP2C9 | |
| SCHEMBL13279471 | 0.84 | SLC6A4 (0.57) | AKR1C3AKR1C2APPCYP3A4CYP2C9 | |
| SCHEMBL3516988 | 0.83 | AKR1C3 (0.58) | AKR1C3AKR1C2APPCYP3A4CYP2C9 | |
| SCHEMBL2795429 | 0.83 | AKR1C3 (0.58) | AKR1C3AKR1C2APPCYP3A4CYP2C9 |
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-2012142067-A2 | FORMULATIONS, SALTS, AND SOLID FORMS OF SUBSTITUTED CYCLOHEXYLMETHANAMINES, PROCESSES FOR PREPARATION, AND USES THEREOF | SUNOVION PHARMACEUTICALS INC. (US) | 2012-10-18 | — | — | WO | disclosed |