Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 2/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 13/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 12/20 | 0.40 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2928983 | 0.92 | GRM2 (0.40) | GRM2HCRTR2HCRTR1PDE4BDHODH | |
| SCHEMBL2925297 | 0.88 | CDK4 (0.36) | HCRTR2HCRTR1PDE4B | |
| SCHEMBL3415876 | 0.88 | CDK4 (0.36) | HCRTR2HCRTR1PDE4B | |
| SCHEMBL2928729 | 0.86 | HCRTR1 (0.42) | HCRTR2HCRTR1CYP46A1 | |
| SCHEMBL2932484 | 0.84 | HCRTR2 (0.41) | GRM2HCRTR2HCRTR1CYP46A1 | |
| SCHEMBL2955879 | 0.84 | HCRTR2 (0.41) | HCRTR2HCRTR1 | |
| SCHEMBL2926251 | 0.84 | HCRTR2 (0.39) | HCRTR2HCRTR1CYP46A1 | |
| SCHEMBL2927512 | 0.84 | CYP46A1 (0.41) | HCRTR2HCRTR1CYP46A1 | |
| SCHEMBL2925490 | 0.83 | PIK3CD (0.37) | HCRTR2HCRTR1PDE4B | |
| SCHEMBL2929940 | 0.83 | HCRTR1 (0.38) | HCRTR2HCRTR1CYP46A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2079690-B1 | 3-AZA-BICYCLO[3.1.0]HEXANE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2010-09-15 | — | — | EP | disclosed |