Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 6/20 | 0.50 |
| ▸ | GSK3B | P49841 | 5/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13289245 | 0.94 | CDK2 (0.49) | CDK2GSK3BCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL13289700 | 0.92 | CDK2 (0.47) | CDK2GSK3BCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL13289334 | 0.92 | CDK2 (0.49) | CDK2GSK3BCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL13121740 | 0.91 | CDK2 (0.63) | CDK2GSK3BCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL14301776 | 0.91 | CDK2 (0.51) | CDK2GSK3BKDREPHB4AURKA | |
| SCHEMBL12954468 | 0.91 | CDK2 (0.51) | CDK2GSK3BMEN1KMT2AEPHB4 | |
| SCHEMBL13289340 | 0.90 | CDK2 (0.48) | CDK2GSK3BPTGER3KDR | |
| SCHEMBL13289304 | 0.90 | CDK2 (0.48) | CDK2GSK3BMEN1KMT2AALDH1A1 | |
| SCHEMBL12954205 | 0.89 | CDK2 (0.49) | CDK2GSK3BPTGER3KDREPHB4 | |
| SCHEMBL13289540 | 0.89 | CDK2 (0.49) | CDK2GSK3BCYP1A2CYP3A4CYP2C19 |
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 |