Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 10/20 | 0.49 |
| ▸ | CCNE1 | P24864 | 9/20 | 0.49 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.49 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.49 |
| ▸ | CDK9 | P50750 | 3/20 | 0.49 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.49 |
| ▸ | CDK7 | P50613 | 2/20 | 0.49 |
| ▸ | CCNH | P51946 | 2/20 | 0.49 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.46 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | BCDIN3D | Q7Z5W3 | 7/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3446753 | 0.91 | CDK2 (0.61) | CDK2CCNE1CDK5CCNT1CDK9 | |
| SCHEMBL3446104 | 0.89 | CDK2 (0.51) | CDK2CCNE1CDK5CCNT1CDK9 | |
| SCHEMBL3445813 | 0.88 | CDK2 (0.50) | CDK2CCNE1CDK5CCNT1CDK9 | |
| SCHEMBL3445042 | 0.86 | CDK2 (0.58) | CDK2CCNE1CDK5CDK5R1CCNE2 | |
| SCHEMBL3445525 | 0.84 | BCDIN3D (0.44) | CDK2CCNE1CDK5CCNT1CDK9 | |
| SCHEMBL3446876 | 0.83 | POLB (0.46) | CDK2CCNE1CDK5CCNT1CDK9 | |
| SCHEMBL3445019 | 0.83 | CDK1 (0.56) | CDK2CCNE1CDK5CCNT1CDK9 | |
| SCHEMBL3445016 | 0.83 | CDK1 (0.56) | CDK2CCNE1CDK5CCNT1CDK9 | |
| SCHEMBL3445950 | 0.82 | POLB (0.52) | CDK2CCNE1CDK5CCNT1CDK9 | |
| SCHEMBL3444226 | 0.81 | BCDIN3D (0.47) | CDK2CCNE1CCNE2CCNA2CCNA1 |
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 |