Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 8/20 | 0.46 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.46 |
| ▸ | CDK4 | P11802 | 4/20 | 0.46 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.46 |
| ▸ | CCND1 | P24385 | 4/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.46 |
| ▸ | CDK2 | P24941 | 4/20 | 0.46 |
| ▸ | CCND3 | P30281 | 4/20 | 0.46 |
| ▸ | CDK7 | P50613 | 4/20 | 0.46 |
| ▸ | CDK9 | P50750 | 4/20 | 0.46 |
| ▸ | CCNH | P51946 | 4/20 | 0.46 |
| ▸ | MNAT1 | P51948 | 4/20 | 0.46 |
| ▸ | CDK6 | Q00534 | 4/20 | 0.46 |
| ▸ | KDM5A | P29375 | 1/20 | 0.38 |
| ▸ | KDM5C | P41229 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | EP300 | Q09472 | 2/20 | 0.38 |
| ▸ | JAK2 | O60674 | 5/20 | 0.37 |
| ▸ | JAK1 | P23458 | 5/20 | 0.37 |
| ▸ | JAK3 | P52333 | 5/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29314874 | 0.80 | CDK1 (0.56) | CDK1CCNT1CDK4CCNB1CCND1 | |
| SCHEMBL29315373 | 0.69 | KDR (0.48) | CDK1CCNT1CDK2CDK9KDR | |
| SCHEMBL30291335 | 0.68 | CDK1 (0.59) | CDK1CCNT1CDK4CCNB1CCND1 | |
| SCHEMBL29314732 | 0.68 | KDR (0.61) | CDK1CCNT1CCNB1CDK2CDK7 | |
| SCHEMBL31121901 | 0.68 | CDK1 (0.67) | CDK1CCNT1CDK4CCNB1CCND1 | |
| SCHEMBL21596384 | 0.66 | KDM5A (0.38) | CDK1CCNT1CDK4CCNB1CCND1 | |
| SCHEMBL21600836 | 0.65 | KDM5A (0.37) | CDK1CCNT1CDK4CCNB1CCND1 | |
| SCHEMBL29314862 | 0.65 | ADORA1 (0.64) | CDK1KDR | |
| SCHEMBL30291202 | 0.64 | CDK1 (0.58) | CDK1CCNT1CDK4CCNB1CCND1 | |
| SCHEMBL29314691 | 0.63 | ADORA1 (0.63) | CDK1KDR |
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 |