Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 7/20 | 0.43 |
| ▸ | GSK3B | P49841 | 7/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13288967 | 0.98 | CDK2 (0.43) | CDK2GSK3BCCNA2CCNA1CYP1A2 | |
| SCHEMBL13289297 | 0.95 | CDK2 (0.44) | CDK2GSK3BCCNA2CCNA1CYP1A2 | |
| SCHEMBL13289033 | 0.92 | GSK3B (0.45) | CDK2GSK3BCCNA2CCNA1CYP1A2 | |
| SCHEMBL12954453 | 0.91 | CDK2 (0.44) | CDK2GSK3BCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL13289499 | 0.90 | GSK3B (0.44) | CDK2GSK3BCCNA2CCNA1CYP1A2 | |
| SCHEMBL12954136 | 0.90 | GSK3B (0.44) | CDK2GSK3BCCNA2CCNA1CYP1A2 | |
| SCHEMBL13121069 | 0.90 | CDK2 (0.56) | CDK2GSK3BCCNA2CCNA1 | |
| SCHEMBL13288972 | 0.90 | CDK2 (0.44) | CDK2GSK3BCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL13289474 | 0.90 | GSK3B (0.46) | CDK2GSK3BCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL13289270 | 0.90 | CDK2 (0.46) | CDK2GSK3BCYP1A2CYP2D6CYP2C19 |
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-2007044449-A2 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2007-04-19 | — | — | WO | disclosed |