Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 8/20 | 0.46 |
| ▸ | CDK1 | P06493 | 6/20 | 0.46 |
| ▸ | CDK9 | P50750 | 4/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.39 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.37 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.37 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3446713 | 0.92 | CDK2 (0.41) | CDK2CDK1CDK9CCNE1CDK5 | |
| SCHEMBL3445601 | 0.90 | CDK2 (0.47) | CDK2CDK1CDK9CCNE1CDK5 | |
| SCHEMBL3445310 | 0.89 | CDK2 (0.49) | CDK2CDK1CDK9CCNE1CDK5 | |
| SCHEMBL3446243 | 0.86 | CDK1 (0.51) | CDK2CDK1CDK9CCNE1CDK5 | |
| SCHEMBL3446242 | 0.86 | CDK1 (0.51) | CDK2CDK1CDK9CCNE1CDK5 | |
| SCHEMBL3445495 | 0.85 | CDK1 (0.51) | CDK2CDK1CDK9CCNE1CDK5 | |
| SCHEMBL3445451 | 0.84 | CDK2 (0.43) | CDK2CDK1CDK9CCNE1CDK5 | |
| SCHEMBL3455226 | 0.84 | CDK2 (0.63) | CDK2CDK1CDK9CCNE1CDK5 | |
| SCHEMBL3445798 | 0.82 | BCDIN3D (0.43) | CDK2CDK1CDK9CCNE1CDK5 | |
| SCHEMBL3445863 | 0.81 | CDK2 (0.49) | CDK2CDK1CDK9CCNE1CDK5 |
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 |