Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 20/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 19/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL1586233 | 0.79 | ALDH1A1 (0.56) | HCRTR1HCRTR2 | |
| SCHEMBL30006500 | 0.79 | ALDH1A1 (0.56) | HCRTR1HCRTR2 | |
| SCHEMBL22383443 | 0.78 | NPC1 (0.46) | HCRTR1HCRTR2 | |
| SCHEMBL14881864 | 0.78 | HCRTR1 (0.42) | HCRTR1HCRTR2CYP3A4 | |
| SCHEMBL5334861 | 0.78 | NPC1 (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL23245765 | 0.78 | ALDH1A1 (0.54) | HCRTR1HCRTR2 | |
| SCHEMBL15833920 | 0.78 | HCRTR1 (0.43) | HCRTR1HCRTR2 | |
| SCHEMBL31227600 | 0.78 | NPC1 (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL8122598 | 0.78 | ALDH1A1 (0.44) | HCRTR1HCRTR2 | |
| SCHEMBL12150154 | 0.78 | HCRTR2 (0.45) | 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-3287454-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-02-28 | — | — | EP | disclosed |