Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 7/20 | 0.56 |
| ▸ | FAAH | O00519 | 2/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.43 |
| ▸ | CLK1 | P49759 | 3/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | CLK2 | P49760 | 1/20 | 0.43 |
| ▸ | CLK3 | P49761 | 1/20 | 0.43 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.43 |
| ▸ | UBE2M | P61081 | 1/20 | 0.42 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14607118 | 0.92 | GSK3B (0.53) | GSK3BFAAHMCHR1ACHEBACE1 | |
| SCHEMBL13122043 | 0.91 | GSK3B (0.70) | GSK3BCDK2 | |
| SCHEMBL12954525 | 0.88 | GSK3B (0.61) | GSK3BCHEK1CDK2 | |
| SCHEMBL14418882 | 0.88 | GSK3B (0.54) | GSK3BCHEK1CDK2 | |
| SCHEMBL13288850 | 0.88 | GSK3B (0.52) | GSK3BFAAHKDM4EALDH1A1GAA | |
| SCHEMBL13289787 | 0.87 | GSK3B (0.59) | GSK3BCHEK1CDK2 | |
| SCHEMBL13289352 | 0.87 | GSK3B (0.58) | GSK3BCHEK1CDK2 | |
| SCHEMBL14043403 | 0.86 | GSK3B (0.60) | GSK3BCHEK1CDK2 | |
| SCHEMBL14050829 | 0.86 | GSK3B (0.61) | GSK3BCHEK1CDK2 | |
| SCHEMBL13289421 | 0.85 | GSK3B (0.58) | GSK3BCHEK1CDK2CYP3A4 |
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 |