Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B13 | Q7Z5P4 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29896160 | 1.00 | POLB (0.43) | POLBROCK2SLC2A1CDK2GSK3B | |
| SCHEMBL29896172 | 0.93 | MAPT (0.41) | POLBROCK2GSK3BALDH1A1EPHX2 | |
| SCHEMBL27188857 | 0.93 | MAPT (0.41) | POLBROCK2GSK3BALDH1A1EPHX2 | |
| SCHEMBL23143270 | 0.89 | POLB (0.44) | POLBROCK2GSK3BUSP2ALDH1A1 | |
| SCHEMBL29896088 | 0.89 | POLB (0.44) | POLBROCK2GSK3BUSP2ALDH1A1 | |
| SCHEMBL29896176 | 0.88 | PIK3CA (0.42) | ROCK2SLC2A1HSD17B13 | |
| SCHEMBL27188849 | 0.88 | PIK3CA (0.42) | ROCK2SLC2A1HSD17B13 | |
| SCHEMBL29896099 | 0.85 | SCN9A (0.39) | POLBROCK2CDK2GSK3BALDH1A1 | |
| SCHEMBL23143259 | 0.85 | SCN9A (0.39) | POLBROCK2CDK2GSK3BALDH1A1 | |
| SCHEMBL29896103 | 0.81 | GAA (0.41) | POLBROCK2GSK3BEPHX2MAPT |
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-4034257-B1 | HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICALS CO (JP) | 2024-05-22 | — | — | EP | claimed |
| EP-4034257-B1 | HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICALS CO (JP) | 2024-05-22 | — | — | EP | disclosed |