Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 12/20 | 0.68 |
| ▸ | EGFR | P00533 | 11/20 | 0.68 |
| ▸ | IGF1R | P08069 | 11/20 | 0.62 |
| ▸ | INSR | P06213 | 10/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.61 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL21558123 | 0.97 | EGFR (0.68) | ALKEGFRIGF1RINSRKCNH2 | |
| SCHEMBL22520226 | 0.93 | EGFR (0.58) | ALKEGFRIGF1RINSRKCNH2 | |
| SCHEMBL25449395 | 0.92 | ALK (0.61) | ALKEGFRIGF1RINSRKCNH2 | |
| SCHEMBL29253608 | 0.92 | EGFR (0.57) | ALKEGFRIGF1RINSRKCNH2 | |
| SCHEMBL28649641 | 0.91 | ALK (0.68) | ALKEGFRIGF1RINSRKCNH2 | |
| SCHEMBL16780916 | 0.90 | ALK (0.78) | ALKEGFRIGF1RINSRCHEK1 | |
| SCHEMBL31196996 | 0.90 | ALK (0.78) | ALKEGFRIGF1RINSRCHEK1 | |
| SCHEMBL19027963 | 0.90 | ALK (0.71) | ALKEGFRIGF1RINSRKCNH2 | |
| SCHEMBL23248546 | 0.90 | EGFR (0.72) | ALKEGFRIGF1RINSR | |
| SCHEMBL19027783 | 0.90 | ALK (0.72) | ALKEGFRIGF1RINSRKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113677680-B | EGFR inhibitor, composition and application thereof | 贝达药业股份有限公司 | 2024-05-10 | — | — | CN | disclosed |