Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 14/20 | 0.49 |
| ▸ | CCNE1 | P24864 | 10/20 | 0.49 |
| ▸ | CDK9 | P50750 | 7/20 | 0.49 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.49 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.49 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.49 |
| ▸ | CDK1 | P06493 | 11/20 | 0.48 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.48 |
| ▸ | CCNB2 | O95067 | 4/20 | 0.48 |
| ▸ | CCNB3 | Q8WWL7 | 4/20 | 0.48 |
| ▸ | CACNA1B | Q00975 | 4/20 | 0.48 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.46 |
| ▸ | CCNT2 | O60583 | 1/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.45 |
| ▸ | CCNA1 | P78396 | 4/20 | 0.45 |
| ▸ | CDK7 | P50613 | 4/20 | 0.44 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.44 |
| ▸ | CLK2 | P49760 | 2/20 | 0.44 |
| ▸ | CSNK1G2 | P78368 | 2/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3446034 | 0.90 | CDK2 (0.50) | CDK2CCNE1CDK9CDK5CCNT1 | |
| SCHEMBL3445571 | 0.88 | CDK1 (0.48) | CDK2CCNE1CDK9CDK5CCNT1 | |
| SCHEMBL3445566 | 0.88 | CDK1 (0.48) | CDK2CCNE1CDK9CDK5CCNT1 | |
| SCHEMBL3446730 | 0.88 | CDK2 (0.53) | CDK2CCNE1CDK9CDK5CCNT1 | |
| SCHEMBL3445399 | 0.88 | CDK2 (0.59) | CDK2CCNE1CDK9CDK5CCNT1 | |
| SCHEMBL3444541 | 0.85 | CDK2 (0.56) | CDK2CCNE1CDK9CDK5CCNT1 | |
| SCHEMBL3446777 | 0.83 | CDK2 (0.41) | CDK2CCNE1CDK9CDK5CCNT1 | |
| SCHEMBL3455978 | 0.83 | CDK2 (0.70) | CDK2CCNE1CDK9CDK5CCNT1 | |
| SCHEMBL3445250 | 0.83 | BCDIN3D (0.40) | CDK2CCNE1CDK9CDK5CCNT1 | |
| SCHEMBL3446887 | 0.82 | CDK2 (0.51) | CDK2CCNE1CDK9CDK5CCNT1 |
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 |