Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 19/20 | 0.55 |
| ▸ | HCRTR2 | O43614 | 17/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1572409 | 1.00 | HCRTR1 (0.55) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL1572100 | 1.00 | HCRTR1 (0.55) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL1572102 | 1.00 | HCRTR1 (0.55) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL1571807 | 0.85 | HCRTR1 (0.60) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL1572226 | 0.84 | HCRTR1 (0.60) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL1571974 | 0.84 | HCRTR1 (0.60) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL1572044 | 0.81 | HCRTR1 (0.60) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL1571461 | 0.80 | HCRTR1 (0.57) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL1572222 | 0.79 | HCRTR1 (0.63) | HCRTR1HCRTR2 | |
| SCHEMBL1571801 | 0.79 | HCRTR1 (0.63) | HCRTR1HCRTR2 |
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-2094690-B1 | 2-AZA-BICYCLO[3.1.0]HEXANE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2011-04-13 | — | — | EP | disclosed |