Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 6/20 | 0.53 |
| ▸ | GSK3B | P49841 | 5/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13289053 | 0.93 | CDK2 (0.53) | CDK2GSK3BCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL14545999 | 0.92 | CDK2 (0.54) | CDK2GSK3BCYP1A2CYP3A4LMNA | |
| SCHEMBL14546000 | 0.92 | CDK2 (0.53) | CDK2GSK3BCYP1A2CYP3A4CA9 | |
| SCHEMBL13288936 | 0.90 | CDK2 (0.50) | CDK2GSK3BCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL13120668 | 0.90 | CDK2 (0.67) | CDK2GSK3BCYP1A2CYP3A4CA12 | |
| SCHEMBL13289272 | 0.89 | GSK3B (0.48) | CDK2GSK3BCYP1A2CYP3A4LMNA | |
| SCHEMBL12954278 | 0.88 | CDK2 (0.52) | CDK2GSK3BCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL13289431 | 0.88 | CDK2 (0.49) | CDK2GSK3BCYP1A2CYP3A4MEN1 | |
| SCHEMBL13289029 | 0.87 | GSK3B (0.47) | CDK2GSK3BCYP1A2CYP3A4LMNA | |
| SCHEMBL13288973 | 0.87 | CDK2 (0.48) | CDK2GSK3BCYP1A2CYP3A4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2194058-A1 | Pyrazolopyrimidines suitable for the treatment of cancer diseases | SCHERING CORPORATION (US) | 2010-06-09 | — | — | EP | disclosed |