Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 3/20 | 0.44 |
| ▸ | CDK2 | P24941 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | BCR | P11274 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | CFTR | P13569 | 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 | |
|---|---|---|---|---|
| SCHEMBL13120073 | 0.90 | GSK3B (0.55) | KMT2AGSK3BCDK2NPC1RAB9A | |
| SCHEMBL13288811 | 0.89 | CDK2 (0.44) | GSK3BCDK2SMN1; SMN2NAMPT | |
| SCHEMBL13289235 | 0.89 | CDK2 (0.45) | KMT2AGSK3BCDK2BRD4HDAC3 | |
| SCHEMBL13289231 | 0.87 | DRD2 (0.46) | GSK3BCDK2HDAC3HDAC1 | |
| SCHEMBL13288868 | 0.87 | CDK2 (0.52) | GSK3BCDK2CYP1A2CYP2C19BRD4 | |
| SCHEMBL13288948 | 0.85 | BRD4 (0.45) | KMT2AGSK3BCDK2MAPTBRD4 | |
| SCHEMBL13120278 | 0.85 | GSK3B (0.57) | KMT2AGSK3BCDK2NPC1RAB9A | |
| SCHEMBL13288952 | 0.85 | CDK2 (0.44) | KMT2AGSK3BCDK2MAPTSMN1; SMN2 | |
| SCHEMBL14545970 | 0.84 | GSK3B (0.45) | GSK3BCDK2CYP1A2CYP2C19HDAC3 | |
| SCHEMBL13288754 | 0.84 | CDK2 (0.45) | KMT2AGSK3BCDK2NPC1RAB9A |
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 |