Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 20/20 | 0.77 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.77 |
| ▸ | EML4 | Q9HC35 | 2/20 | 0.76 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.64 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL19337177 | 0.92 | EGFR (0.76) | EGFRALKEML4KCNH2 | |
| SCHEMBL19089663 | 0.88 | EGFR (0.82) | EGFRALKEML4KCNH2 | |
| SCHEMBL19337095 | 0.88 | EGFR (0.77) | EGFRALKEML4KCNH2PTK2 | |
| SCHEMBL19337163 | 0.87 | EGFR (0.76) | EGFRALKEML4KCNH2PTK2 | |
| SCHEMBL27237904 | 0.87 | EGFR (0.80) | EGFRALKEML4KCNH2PTK2 | |
| SCHEMBL22497616 | 0.87 | EGFR (1.00) | EGFRALKEML4 | |
| SCHEMBL30222929 | 0.87 | EGFR (0.79) | EGFRALKEML4KCNH2PTK2 | |
| SCHEMBL27237906 | 0.85 | EGFR (0.77) | EGFRALKEML4KCNH2PTK2 | |
| SCHEMBL19089369 | 0.85 | EGFR (0.73) | EGFRALKEML4KCNH2PTK2 | |
| SCHEMBL19254476 | 0.85 | EGFR (0.71) | EGFRALKEML4KCNH2 |
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-3216786-A1 | PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF | Shanghai Shaletech Technology Co., Ltd. (CN) | 2017-09-13 | — | — | EP | disclosed |