Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.32 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.32 |
| ▸ | MBOAT4 | Q96T53 | 2/20 | 0.32 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29315908 | 0.90 | LRRK2 (0.40) | LRRK2IRAK4ALDH1A1KDM4EHPGD | |
| SCHEMBL29315949 | 0.77 | LRRK2 (0.48) | LRRK2IRAK4PRKCQPRKCD | |
| SCHEMBL21409882 | 0.77 | CSNK1A1 (0.45) | LRRK2IRAK4ALDH1A1CSNK2A2ACHE | |
| SCHEMBL30662127 | 0.77 | CSNK1A1 (0.45) | LRRK2IRAK4ALDH1A1CSNK2A2ACHE | |
| SCHEMBL29316281 | 0.74 | LRRK2 (0.40) | LRRK2IRAK4PRKCQPRKCD | |
| SCHEMBL20641250 | 0.68 | CSNK1A1 (0.51) | ALDH1A1KDM4EGAAMBOAT4 | |
| SCHEMBL8595874 | 0.68 | ACHE (0.42) | LRRK2PRKCQPRKCDMBOAT4ACHE | |
| SCHEMBL13736333 | 0.67 | NPSR1 (0.44) | LRRK2ALDH1A1KDM4EGAAHPGD | |
| SCHEMBL21066963 | 0.67 | PRKCQ (0.39) | LRRK2ALDH1A1CTSLPRKCQACHE | |
| SCHEMBL21162418 | 0.66 | LRRK2 (0.50) | LRRK2IRAK4PRKCQPRKCD |
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-3782986-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2024-07-10 | — | — | EP | disclosed |