Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 7/20 | 0.47 |
| ▸ | CDK4 | P11802 | 5/20 | 0.47 |
| ▸ | PLK1 | P53350 | 2/20 | 0.44 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.42 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 3/20 | 0.42 |
| ▸ | BCR | P11274 | 2/20 | 0.42 |
| ▸ | PRKCA | P17252 | 2/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.40 |
| ▸ | CDK1 | P06493 | 2/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.40 |
| ▸ | CDK9 | P50750 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14254276 | 0.78 | PIK3CA (0.51) | CDK2CDK4PLK1ALDH1A1ABCG2 | |
| SCHEMBL7084675 | 0.78 | CDK2 (0.52) | CDK2CDK4PLK1AURKBALDH1A1 | |
| SCHEMBL6158465 | 0.77 | CDK2 (0.75) | CDK2CDK4PLK1AURKBABL1 | |
| SCHEMBL6157065 | 0.74 | CDK2 (0.70) | CDK2CDK4PLK1AURKBKDR | |
| SCHEMBL14254270 | 0.74 | SRC (0.50) | CDK2CDK4PLK1IKBKBABL1 | |
| SCHEMBL14254260 | 0.72 | DKK1 (0.59) | PLK1ABCG2ABCC1IKBKBABL1 | |
| SCHEMBL14254274 | 0.72 | ABCG2 (0.54) | CDK2CDK4PLK1AURKBKDR | |
| SCHEMBL14254267 | 0.72 | PIK3CA (0.53) | CDK2PLK1ABCG2IKBKBABL1 | |
| SCHEMBL14254254 | 0.72 | PIK3CA (0.68) | CDK2CDK4PLK1ABCG2IKBKB | |
| SCHEMBL14254259 | 0.71 | CAMK2D (0.61) | CDK2CDK4PLK1ABL1BCR |
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-1274705-A1 | 2-SUBSTITUTED 4-HETEROARYL-PYRIMIDINES AND THEIR USE IN THE TREATMENT OF PROLIFERATIVE DISORDERS | Cyclacel Limited (GB) | 2003-01-15 | — | — | EP | disclosed |
| WO-2001072745-A1 | 2-SUBSTITUTED 4-HETEROARYL-PYRIMIDINES AND THEIR USE IN THE TREATMETN OF PROLIFERATIVE DISORDERS | CYCLACEL LIMITED (GB) | 2001-10-04 | — | — | WO | disclosed |