Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 7/20 | 0.54 |
| ▸ | AURKA | O14965 | 1/20 | 0.54 |
| ▸ | EGFR | P00533 | 1/20 | 0.54 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.54 |
| ▸ | CDK1 | P06493 | 1/20 | 0.54 |
| ▸ | IGF1R | P08069 | 1/20 | 0.54 |
| ▸ | KIT | P10721 | 1/20 | 0.54 |
| ▸ | EPHA1 | P21709 | 1/20 | 0.54 |
| ▸ | CDK2 | P24941 | 1/20 | 0.54 |
| ▸ | FLT3 | P36888 | 1/20 | 0.54 |
| ▸ | BMX | P51813 | 1/20 | 0.54 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.54 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.54 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.54 |
| ▸ | SYK | P43405 | 2/20 | 0.52 |
| ▸ | LCK | P06239 | 2/20 | 0.50 |
| ▸ | CDK4 | P11802 | 1/20 | 0.50 |
| ▸ | CCND1 | P24385 | 1/20 | 0.50 |
| ▸ | JAK2 | O60674 | 5/20 | 0.49 |
| ▸ | JAK1 | P23458 | 5/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12438378 | 0.90 | JAK3 (0.52) | JAK3AURKAEGFRNTRK1CDK1 | |
| SCHEMBL578997 | 0.89 | JAK3 (0.51) | JAK3AURKAEGFRNTRK1CDK1 | |
| Bicarbonate SCHEMBL579262 | 0.83 | KIT (0.64) | JAK3AURKAEGFRNTRK1CDK1 | |
| Bicarbonate SCHEMBL579108 | 0.83 | FLT3 (0.64) | JAK3AURKAEGFRNTRK1CDK1 | |
| SCHEMBL13808257 | 0.83 | KIT (0.57) | JAK3AURKAEGFRNTRK1CDK1 | |
| SCHEMBL578802 | 0.83 | FLT3 (0.61) | JAK3AURKAEGFRNTRK1CDK1 | |
| SCHEMBL4283916 | 0.83 | FLT3 (0.61) | JAK3AURKAEGFRNTRK1CDK1 | |
| SCHEMBL4283914 | 0.83 | FLT3 (0.61) | JAK3AURKAEGFRNTRK1CDK1 | |
| SCHEMBL578803 | 0.83 | FLT3 (0.61) | JAK3AURKAEGFRNTRK1CDK1 | |
| SCHEMBL13808086 | 0.83 | FLT3 (0.61) | JAK3AURKAEGFRNTRK1CDK1 |
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-2027107-B1 | 2, 4 -DIAMINO PYRIMIDINES AS CELL CYCLE KINASE INHIBITORS | BOEHRINGER INGELHEIM INT (DE) | 2012-02-15 | — | — | EP | disclosed |