Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 6/20 | 0.49 |
| ▸ | GSK3B | P49841 | 5/20 | 0.49 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 4/20 | 0.39 |
| ▸ | RET | P07949 | 3/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.38 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.38 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.38 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13289563 | 0.94 | CDK2 (0.50) | CDK2GSK3BEPHB4MEN1KMT2A | |
| SCHEMBL14301776 | 0.94 | CDK2 (0.51) | CDK2GSK3BEPHB4KDRRET | |
| SCHEMBL13289340 | 0.92 | CDK2 (0.48) | CDK2GSK3BKDRRETKCNJ6 | |
| SCHEMBL12954120 | 0.92 | CDK2 (0.49) | CDK2GSK3BEPHB4KDRRET | |
| SCHEMBL12954468 | 0.92 | CDK2 (0.51) | CDK2GSK3BEPHB4MEN1KMT2A | |
| SCHEMBL13289534 | 0.91 | RET (0.48) | CDK2GSK3BCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL13289700 | 0.91 | CDK2 (0.47) | CDK2GSK3BEPHB4MEN1KMT2A | |
| SCHEMBL13121743 | 0.91 | CDK2 (0.62) | CDK2GSK3BKDR | |
| SCHEMBL13289334 | 0.91 | CDK2 (0.49) | CDK2GSK3BEPHB4MEN1KMT2A | |
| SCHEMBL13289326 | 0.90 | CDK2 (0.47) | CDK2GSK3BEPHB4MEN1KMT2A |
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 |