Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 12/20 | 0.75 |
| ▸ | ALK | Q9UM73 | 10/20 | 0.66 |
| ▸ | INSR | P06213 | 7/20 | 0.66 |
| ▸ | IGF1R | P08069 | 7/20 | 0.66 |
| ▸ | MET | P08581 | 3/20 | 0.62 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.61 |
| ▸ | AURKA | O14965 | 2/20 | 0.61 |
| ▸ | NUAK1 | O60285 | 2/20 | 0.61 |
| ▸ | JAK2 | O60674 | 2/20 | 0.61 |
| ▸ | STK10 | O94804 | 2/20 | 0.61 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.61 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.61 |
| ▸ | ABL1 | P00519 | 2/20 | 0.61 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.61 |
| ▸ | LCK | P06239 | 2/20 | 0.61 |
| ▸ | FYN | P06241 | 2/20 | 0.61 |
| ▸ | FES | P07332 | 2/20 | 0.61 |
| ▸ | CSF1R | P07333 | 2/20 | 0.61 |
| ▸ | YES1 | P07947 | 2/20 | 0.61 |
| ▸ | LYN | P07948 | 2/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL24351525 | 1.00 | EGFR (0.75) | EGFRALKINSRIGF1RMET | |
| SCHEMBL26778364 | 0.93 | ALK (0.77) | EGFRALKINSRIGF1RMET | |
| SCHEMBL29661303 | 0.89 | ALK (0.75) | EGFRALKINSRIGF1RMET | |
| SCHEMBL26778353 | 0.89 | ALK (0.75) | EGFRALKINSRIGF1RMET | |
| SCHEMBL24327081 | 0.88 | EGFR (0.73) | EGFRALKINSRIGF1RMET | |
| SCHEMBL24326974 | 0.87 | EGFR (0.74) | EGFRALKINSRIGF1RMET | |
| SCHEMBL27220775 | 0.87 | EGFR (0.77) | EGFRALKINSRIGF1RMET | |
| SCHEMBL24328315 | 0.87 | ALK (0.73) | EGFRALKINSRIGF1RMET | |
| SCHEMBL30872012 | 0.86 | ALK (0.72) | EGFRALKINSRIGF1RMET | |
| SCHEMBL25014435 | 0.86 | ALK (0.72) | EGFRALKINSRIGF1RMET |
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 |
|---|---|---|---|---|---|---|---|
| CN-117794914-A | Pyrimidine-2, 4-diamine derivatives, process for preparing the same, and pharmaceutical composition for preventing or treating cancer comprising the same as active ingredient | 韩国化学研究院 | 2024-03-29 | — | — | CN | claimed |
| CN-117794914-A | Pyrimidine-2, 4-diamine derivatives, process for preparing the same, and pharmaceutical composition for preventing or treating cancer comprising the same as active ingredient | 韩国化学研究院 | 2024-03-29 | — | — | CN | disclosed |