Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 17/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 16/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.33 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2931914 | 0.90 | HCRTR2 (0.39) | HCRTR2HCRTR1 | |
| SCHEMBL2931040 | 0.89 | HCRTR2 (0.40) | HCRTR2HCRTR1 | |
| SCHEMBL2930074 | 0.87 | SLC6A7 (0.35) | HCRTR2HCRTR1 | |
| SCHEMBL2930955 | 0.86 | HCRTR2 (0.38) | HCRTR2HCRTR1 | |
| SCHEMBL2928147 | 0.86 | HCRTR1 (0.36) | HCRTR2HCRTR1CYP3A4FFAR1GRIN2B | |
| SCHEMBL2924244 | 0.85 | CYP46A1 (0.39) | HCRTR2HCRTR1 | |
| SCHEMBL2925368 | 0.84 | HCRTR1 (0.41) | HCRTR2HCRTR1GRIN2B | |
| SCHEMBL2925493 | 0.84 | HCRTR2 (0.37) | HCRTR2HCRTR1 | |
| SCHEMBL2930216 | 0.83 | TP53 (0.39) | — | |
| SCHEMBL2929658 | 0.83 | HCRTR2 (0.36) | HCRTR2HCRTR1CYP3A4GRIN2B |
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 |