Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | CCR6 | P51684 | 1/20 | 0.52 |
| ▸ | METAP1 | P53582 | 3/20 | 0.42 |
| ▸ | HTR6 | P50406 | 4/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | CYP27A1 | Q02318 | 2/20 | 0.39 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL2969421 | 0.96 | HSP90AA1 (0.55) | HSP90AA1CCR6METAP1HTR6NCOA1 | |
| Hydrochloric Acid SCHEMBL6293297 | 0.95 | HSP90AA1 (0.57) | HSP90AA1CCR6METAP1HTR6NCOA1 | |
| SCHEMBL6293028 | 0.88 | METAP1 (0.41) | HSP90AA1CCR6METAP1HTR6 | |
| SCHEMBL6297691 | 0.84 | METAP1 (0.45) | HSP90AA1CCR6METAP1HTR6 | |
| SCHEMBL6681699 | 0.84 | HSP90AA1 (0.47) | HSP90AA1CCR6METAP1HTR6OPRK1 | |
| SCHEMBL6293299 | 0.83 | METAP1 (0.46) | HSP90AA1CCR6METAP1HTR6 | |
| SCHEMBL6293241 | 0.82 | HSP90AA1 (0.40) | HSP90AA1CCR6METAP1HTR6NCOA1 | |
| SCHEMBL6677866 | 0.81 | HSP90AA1 (0.49) | HSP90AA1CCR6METAP1HTR6OPRK1 | |
| SCHEMBL6677864 | 0.81 | HSP90AA1 (0.49) | HSP90AA1CCR6METAP1HTR6OPRK1 | |
| SCHEMBL6294309 | 0.81 | SLC6A3 (0.40) | HSP90AA1CCR6METAP1HTR6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1246791-A2 | AMINOMETHYL-PHENYL-CYCLOHEXANONE DERIVATIVES | Grünenthal GmbH (DE) | 2002-10-09 | — | — | EP | claimed |
| WO-2001049651-A2 | AMINOMETHYL-PHENYL-CYCLOHEXANONE DERIVATIVES | Grünenthal GmbH (DE) | 2001-07-12 | — | — | WO | claimed |