Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 20/20 | 0.50 |
| ▸ | CCNE1 | P24864 | 19/20 | 0.50 |
| ▸ | CCNE2 | O96020 | 16/20 | 0.48 |
| ▸ | CDK1 | P06493 | 4/20 | 0.48 |
| ▸ | CDK4 | P11802 | 3/20 | 0.48 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.48 |
| ▸ | CCND1 | P24385 | 3/20 | 0.48 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.48 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.48 |
| ▸ | CCNA2 | P20248 | 14/20 | 0.48 |
| ▸ | CCNA1 | P78396 | 13/20 | 0.48 |
| ▸ | FLT3 | P36888 | 1/20 | 0.46 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.44 |
| ▸ | CDK9 | P50750 | 2/20 | 0.44 |
| ▸ | CCNT2 | O60583 | 1/20 | 0.44 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3445863 | 0.91 | CDK2 (0.49) | CDK2CCNE1CCNE2CDK1CDK4 | |
| SCHEMBL3445487 | 0.90 | CDK2 (0.51) | CDK2CCNE1CCNE2CDK1CDK4 | |
| SCHEMBL3444858 | 0.87 | BCDIN3D (0.47) | CDK2CCNE1CCNE2CDK1CDK4 | |
| SCHEMBL3444248 | 0.85 | CDK2 (0.51) | CDK2CCNE1CCNE2CDK1CDK4 | |
| SCHEMBL3444810 | 0.84 | CDK2 (0.49) | CDK2CCNE1CCNE2CDK1CDK4 | |
| SCHEMBL3444437 | 0.83 | CDK2 (0.65) | CDK2CCNE1CCNE2CDK1CDK4 | |
| SCHEMBL3445798 | 0.82 | BCDIN3D (0.43) | CDK2CCNE1CCNE2CDK1CCNB1 | |
| SCHEMBL3445601 | 0.81 | CDK2 (0.47) | CDK2CCNE1CCNE2CDK1CCNB1 | |
| SCHEMBL3444811 | 0.80 | CDK2 (0.44) | CDK2CCNE1CCNE2CDK1CDK4 | |
| SCHEMBL3446119 | 0.79 | CDK1 (0.53) | CDK2CCNE1CCNE2CDK1CDK4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7816350-B2 | Substituted [1,2,3] triazolo[4,5-D]pyrimidines as cdk inhibitors | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2010-10-19 | — | — | US | claimed |