Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 12/20 | 0.50 |
| ▸ | ROS1 | P08922 | 7/20 | 0.50 |
| ▸ | EGFR | P00533 | 9/20 | 0.47 |
| ▸ | MET | P08581 | 2/20 | 0.45 |
| ▸ | INSR | P06213 | 5/20 | 0.43 |
| ▸ | IGF1R | P08069 | 5/20 | 0.43 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.40 |
| ▸ | PLK4 | O00444 | 1/20 | 0.40 |
| ▸ | STK25 | O00506 | 1/20 | 0.40 |
| ▸ | RIOK3 | O14730 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | CASK | O14936 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | GAK | O14976 | 1/20 | 0.40 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.40 |
| ▸ | MUSK | O15146 | 1/20 | 0.40 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | MAP3K13 | O43283 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 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 | |
|---|---|---|---|---|
| SCHEMBL26906727 | 1.00 | ALK (0.50) | ALKROS1EGFRMETINSR | |
| SCHEMBL29114860 | 0.91 | ALK (0.47) | ALKROS1EGFRMETINSR | |
| SCHEMBL26906899 | 0.88 | EGFR (0.49) | ALKEGFRMETINSRIGF1R | |
| SCHEMBL26907013 | 0.87 | ALK (0.52) | ALKEGFRMETINSRIGF1R | |
| SCHEMBL26906910 | 0.85 | ALK (0.63) | ALKROS1EGFRMETINSR | |
| SCHEMBL29904634 | 0.85 | ALK (0.63) | ALKROS1EGFRMETINSR | |
| SCHEMBL29904643 | 0.83 | EGFR (0.42) | ALKEGFRMETINSRIGF1R | |
| SCHEMBL26906780 | 0.83 | EGFR (0.42) | ALKEGFRMETINSRIGF1R | |
| SCHEMBL29114855 | 0.83 | ALK (0.56) | ALKROS1EGFRMETINSR | |
| SCHEMBL26906903 | 0.82 | EGFR (0.44) | EGFRJAK2CDK4JAK1TYK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022211573-A1 | PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME | 주식회사 테라펙스 | 2022-10-06 | — | — | WO | claimed |
| WO-2022211573-A1 | PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME | 주식회사 테라펙스 | 2022-10-06 | — | — | WO | disclosed |