Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 1/20 | 0.41 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.41 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PRKCQ | Q04759 | 7/20 | 0.38 |
| ▸ | PRKCD | Q05655 | 6/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29313537 | 0.84 | PTK2 (0.56) | PTK2PTK2BMEN1ALDH1A1KMT2A | |
| SCHEMBL29313552 | 0.84 | PTK2 (0.43) | PTK2PTK2BCYP1A2CYP3A4TDP1 | |
| SCHEMBL29313615 | 0.80 | VNN1 (0.47) | PTK2PTK2BCYP1A2CYP3A4TDP1 | |
| SCHEMBL29313606 | 0.78 | PTK2 (0.40) | PTK2PTK2BPRKCQAURKALRRK2 | |
| SCHEMBL29313542 | 0.78 | ALDH1A1 (0.54) | CYP1A2CYP3A4TDP1HSD17B10MAPK14 | |
| SCHEMBL29315070 | 0.76 | MAP3K8 (0.45) | PTK2PTK2BPRKCQPRKCDAURKA | |
| SCHEMBL29315097 | 0.74 | MAP3K8 (0.43) | PTK2PTK2BPRKCQAURKALRRK2 | |
| SCHEMBL29313773 | 0.72 | CCNA2 (0.46) | PRKCQAURKAALDH1A1HPGDLRRK2 | |
| SCHEMBL18419822 | 0.69 | MKNK2 (0.60) | KCNH3MKNK1MKNK2 | |
| SCHEMBL29314042 | 0.68 | NUDT1 (0.45) | PRKCQPRKCDAURKALRRK2SYK |
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 |