Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 18/20 | 0.54 |
| ▸ | CCNE1 | P24864 | 16/20 | 0.54 |
| ▸ | CDK5 | Q00535 | 11/20 | 0.49 |
| ▸ | CCNE2 | O96020 | 3/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.49 |
| ▸ | CDK1 | P06493 | 5/20 | 0.46 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.46 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.46 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.46 |
| ▸ | CDK9 | P50750 | 5/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.44 |
| ▸ | CDK7 | P50613 | 2/20 | 0.44 |
| ▸ | CCNH | P51946 | 1/20 | 0.44 |
| ▸ | CCNT2 | O60583 | 2/20 | 0.43 |
| ▸ | CDK4 | P11802 | 2/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.43 |
| ▸ | CCND1 | P24385 | 2/20 | 0.43 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3718371 | 0.86 | CDK2 (0.54) | CDK2CCNE1CDK5CCNE2AURKA | |
| SCHEMBL3718466 | 0.85 | CCNE1 (0.43) | CDK2CCNE1CCNE2CDK9CCNT1 | |
| SCHEMBL3721972 | 0.85 | CDK2 (0.60) | CDK2CCNE1CDK5CCNE2AURKA | |
| SCHEMBL3720115 | 0.82 | CDK2 (0.51) | CDK2CCNE1CDK5CCNE2AURKA | |
| SCHEMBL3719470 | 0.81 | CDK2 (0.68) | CDK2CCNE1CDK5CCNE2AURKA | |
| SCHEMBL2904678 | 0.80 | CDK2 (0.69) | CDK2CCNE1CDK5CCNE2AURKA | |
| SCHEMBL3717711 | 0.77 | CDK2 (0.53) | CDK2CCNE1CDK5CCNE2AURKA | |
| SCHEMBL3717049 | 0.75 | CDK2 (0.50) | CDK2CCNE1CDK5CCNE2AURKA | |
| SCHEMBL3718378 | 0.71 | CDK2 (0.43) | CDK2CCNE1CCNE2CDK1CCNB1 | |
| SCHEMBL3444888 | 0.71 | CCNE1 (0.46) | CDK2CCNE1CCNE2CDK9CCNT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010139288-A1 | 5,7-DISUBSTITUTED 3-ISOPROPYLPYRAZOLO[4,3-D]PYRIMIDINES FOR USE AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS | C3 BIO GMBH (DE) | 2010-12-09 | — | — | WO | disclosed |