Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 11/20 | 0.63 |
| ▸ | ALK | Q9UM73 | 10/20 | 0.57 |
| ▸ | INSR | P06213 | 7/20 | 0.57 |
| ▸ | IGF1R | P08069 | 7/20 | 0.57 |
| ▸ | ROS1 | P08922 | 3/20 | 0.57 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.57 |
| ▸ | AURKA | O14965 | 1/20 | 0.57 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.57 |
| ▸ | JAK2 | O60674 | 1/20 | 0.57 |
| ▸ | STK10 | O94804 | 1/20 | 0.57 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.57 |
| ▸ | SLC34A2 | O95436 | 1/20 | 0.57 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.57 |
| ▸ | ABL1 | P00519 | 1/20 | 0.57 |
| ▸ | CD74 | P04233 | 1/20 | 0.57 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.57 |
| ▸ | LCK | P06239 | 1/20 | 0.57 |
| ▸ | FYN | P06241 | 1/20 | 0.57 |
| ▸ | FES | P07332 | 1/20 | 0.57 |
| ▸ | CSF1R | P07333 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL29114865 | 1.00 | EGFR (0.63) | EGFRALKINSRIGF1RROS1 | |
| SCHEMBL22595122 | 0.92 | EGFR (0.75) | EGFR | |
| SCHEMBL25789201 | 0.90 | EGFR (0.63) | EGFRALK | |
| SCHEMBL26906713 | 0.89 | EGFR (0.67) | EGFRALKINSRIGF1RROS1 | |
| SCHEMBL22028077 | 0.88 | EGFR (0.76) | EGFRALKINSRIGF1RROS1 | |
| SCHEMBL26906870 | 0.88 | EGFR (0.60) | EGFRALKINSRIGF1RROS1 | |
| SCHEMBL26907011 | 0.87 | ALK (0.64) | EGFRALKINSRIGF1RROS1 | |
| SCHEMBL29904627 | 0.87 | ALK (0.64) | EGFRALKINSRIGF1RROS1 | |
| SCHEMBL30659734 | 0.87 | ALK (0.62) | EGFRALKINSRIGF1RROS1 | |
| SCHEMBL26906900 | 0.87 | EGFR (0.59) | EGFRALKROS1 |
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 |