Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 18/20 | 0.52 |
| ▸ | CDK4 | P11802 | 14/20 | 0.47 |
| ▸ | CDK1 | P06493 | 4/20 | 0.47 |
| ▸ | CDK7 | P50613 | 4/20 | 0.47 |
| ▸ | CDK9 | P50750 | 4/20 | 0.47 |
| ▸ | AURKA | O14965 | 3/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.47 |
| ▸ | PLK1 | P53350 | 3/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.43 |
| ▸ | CCND1 | P24385 | 1/20 | 0.43 |
| ▸ | CCNH | P51946 | 1/20 | 0.43 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8314041 | 0.85 | CDK2 (0.52) | CDK2CDK4CDK1CDK7CDK9 | |
| SCHEMBL5620875 | 0.83 | CDK2 (0.76) | CDK2CDK4CDK1CDK7CDK9 | |
| SCHEMBL5785381 | 0.82 | CDK2 (0.58) | CDK2CDK4CDK1CDK7CDK9 | |
| SCHEMBL5620822 | 0.81 | CDK2 (0.69) | CDK2CDK4CDK1CDK7CDK9 | |
| SCHEMBL1415012 | 0.81 | CDK2 (0.67) | CDK2CDK4CDK1CDK7CDK9 | |
| SCHEMBL5621800 | 0.80 | CDK2 (0.70) | CDK2CDK4CDK1CDK7CDK9 | |
| SCHEMBL8311832 | 0.80 | CLK4 (0.49) | CDK2CDK4CDK1CDK7CDK9 | |
| SCHEMBL4397546 | 0.78 | CDK2 (0.50) | CDK2CDK4CDK1CDK7CDK9 | |
| SCHEMBL2087406 | 0.77 | CDK2 (0.61) | CDK2CDK4CDK1CDK7CDK9 | |
| SCHEMBL4388874 | 0.76 | SYK (0.70) | CDK2SYK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005012298-A1 | PYRIDINYLAMINO-PYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | CYCLACEL LIMITED (GB) | 2005-02-10 | — | — | WO | disclosed |