Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 15/20 | 0.44 |
| ▸ | CDK4 | P11802 | 12/20 | 0.44 |
| ▸ | AURKA | O14965 | 4/20 | 0.43 |
| ▸ | CDK1 | P06493 | 4/20 | 0.43 |
| ▸ | CDK9 | P50750 | 4/20 | 0.43 |
| ▸ | CDK7 | P50613 | 3/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.43 |
| ▸ | ABL1 | P00519 | 3/20 | 0.43 |
| ▸ | BCR | P11274 | 2/20 | 0.43 |
| ▸ | PRKCA | P17252 | 2/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.42 |
| ▸ | PLK1 | P53350 | 2/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCNH | P51946 | 1/20 | 0.40 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5162379 | 0.83 | ABL1 (0.45) | CDK2CDK4AURKACDK1CDK9 | |
| SCHEMBL27720404 | 0.81 | CDK2 (0.67) | CDK2CDK4AURKACDK1CDK9 | |
| SCHEMBL12278950 | 0.81 | CDK2 (0.51) | CDK2CDK4AURKACDK1CDK9 | |
| SCHEMBL6156440 | 0.79 | CDK2 (0.67) | CDK2CDK4AURKACDK1CDK9 | |
| SCHEMBL5164219 | 0.78 | CDK2 (0.59) | CDK2CDK4AURKACDK1CDK9 | |
| SCHEMBL4157090 | 0.77 | CLK1 (0.57) | CDK2CDK4AURKACDK1CDK9 | |
| SCHEMBL4164507 | 0.77 | CDK4 (0.52) | CDK2CDK4AURKACDK1CDK9 | |
| SCHEMBL4173509 | 0.77 | CDK2 (0.71) | CDK2CDK4AURKACDK1CDK9 | |
| SCHEMBL4164771 | 0.77 | ZAP70 (0.54) | CDK2CDK4AURKACDK1CDK9 | |
| SCHEMBL4176513 | 0.76 | CDK2 (0.60) | CDK2CDK4AURKACDK1CDK9 |
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-1756098-A2 | 2-SUBSTITUTED-4-HETEROARYL-PYRIMIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | Cyclacel Limited (GB) | 2007-02-28 | — | — | EP | disclosed |
| WO-2005116025-A2 | 2-SUBSTITUTED-4-HETEROARYL-PYRIMIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | CYCLACEL LIMITED (GB) | 2005-12-08 | — | — | WO | disclosed |