Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 19/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 15/20 | 0.42 |
| ▸ | CASP6 | P55212 | 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 | |
|---|---|---|---|---|
| SCHEMBL29628797 | 0.83 | KEAP1 (0.49) | HCRTR1HCRTR2 | |
| SCHEMBL1586918 | 0.83 | KEAP1 (0.49) | HCRTR1HCRTR2 | |
| SCHEMBL15836281 | 0.78 | HCRTR1 (0.49) | HCRTR1HCRTR2 | |
| SCHEMBL16666096 | 0.78 | LMNA (0.47) | HCRTR1HCRTR2 | |
| SCHEMBL17250838 | 0.74 | HCRTR1 (0.47) | HCRTR1HCRTR2 | |
| SCHEMBL17069783 | 0.74 | HCRTR1 (0.47) | HCRTR1HCRTR2 | |
| SCHEMBL1585974 | 0.74 | HCRTR1 (0.49) | HCRTR1HCRTR2 | |
| SCHEMBL18594669 | 0.74 | HCRTR1 (0.47) | HCRTR1HCRTR2 | |
| SCHEMBL27918769 | 0.74 | KMO (0.44) | CASP6 | |
| SCHEMBL1586269 | 0.72 | NAPRT (0.49) | HCRTR1HCRTR2CASP6 |
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-3287454-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2020-09-02 | — | — | EP | disclosed |
| EP-3287454-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-02-28 | — | — | EP | disclosed |