Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE1 | P24864 | 13/20 | 0.44 |
| ▸ | CDK2 | P24941 | 13/20 | 0.44 |
| ▸ | CDK9 | P50750 | 8/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 8/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 7/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 6/20 | 0.44 |
| ▸ | CDK7 | P50613 | 5/20 | 0.44 |
| ▸ | CCNH | P51946 | 4/20 | 0.44 |
| ▸ | CCNT2 | O60583 | 2/20 | 0.41 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.41 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.33 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.33 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 2/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.32 |
| ▸ | PLK4 | O00444 | 1/20 | 0.31 |
| ▸ | BCDIN3D | Q7Z5W3 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3718696 | 0.87 | CDK2 (0.43) | CCNE1CDK2CDK9CDK5CCNT1 | |
| SCHEMBL3720105 | 0.86 | CDK2 (0.44) | CCNE1CDK2CDK9CDK5CCNT1 | |
| SCHEMBL3722157 | 0.85 | CDK2 (0.57) | CCNE1CDK2CDK9CDK5CCNT1 | |
| SCHEMBL3720124 | 0.85 | CCNE1 (0.43) | CCNE1CDK2CDK9CDK5CCNT1 | |
| SCHEMBL3721978 | 0.83 | CCNE1 (0.42) | CCNE1CDK2CDK9CDK5CCNT1 | |
| SCHEMBL3719282 | 0.80 | CDK2 (0.64) | CCNE1CDK2CDK9CDK5CCNT1 | |
| SCHEMBL3724863 | 0.79 | CDK2 (0.50) | CCNE1CDK2CDK9CDK5CCNT1 | |
| SCHEMBL3794940 | 0.79 | CDK2 (0.35) | CCNE1CDK2CDK9CDK5CDK7 | |
| SCHEMBL3724487 | 0.76 | CDK2 (0.47) | CCNE1CDK2CDK9CDK5CCNT1 | |
| SCHEMBL18396850 | 0.75 | CDK2 (0.44) | CCNE1CDK2CDK9CDK5CCNT1 |
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 |