Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 9/20 | 0.55 |
| ▸ | CCNE1 | P24864 | 7/20 | 0.55 |
| ▸ | CDK1 | P06493 | 11/20 | 0.54 |
| ▸ | CCNK | O75909 | 7/20 | 0.53 |
| ▸ | CDK12 | Q9NYV4 | 7/20 | 0.53 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.51 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.51 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.51 |
| ▸ | CDK7 | P50613 | 5/20 | 0.50 |
| ▸ | CDK9 | P50750 | 5/20 | 0.50 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.50 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.50 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.50 |
| ▸ | CDK4 | P11802 | 3/20 | 0.50 |
| ▸ | CCND1 | P24385 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | CCNH | P51946 | 3/20 | 0.50 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.50 |
| ▸ | CLK2 | P49760 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3445309 | 0.90 | CDK2 (0.52) | CDK2CCNE1CDK1CCNKCDK12 | |
| SCHEMBL3444370 | 0.89 | CDK2 (0.54) | CDK2CCNE1CDK1CCNKCDK12 | |
| SCHEMBL3444366 | 0.89 | CDK2 (0.54) | CDK2CCNE1CDK1CCNKCDK12 | |
| SCHEMBL3446887 | 0.89 | CDK2 (0.51) | CDK2CCNE1CDK1CCNKCDK12 | |
| SCHEMBL3446513 | 0.86 | CDK5 (0.53) | CDK2CCNE1CDK1CCNKCDK12 | |
| SCHEMBL3446103 | 0.84 | CDK1 (0.51) | CDK2CCNE1CDK1CCNKCDK12 | |
| SCHEMBL3445000 | 0.84 | CDK2 (0.47) | CDK2CCNE1CDK1CDK9CDK5 | |
| SCHEMBL3445122 | 0.84 | CDK1 (0.69) | CDK2CCNE1CDK1CCNKCDK12 | |
| SCHEMBL3444679 | 0.84 | CDK1 (0.69) | CDK2CCNE1CDK1CCNKCDK12 | |
| SCHEMBL3445192 | 0.83 | CDK1 (0.72) | CDK2CCNE1CDK1CCNKCDK12 |
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 |