Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 9/20 | 0.40 |
| ▸ | INSR | P06213 | 8/20 | 0.40 |
| ▸ | IGF1R | P08069 | 8/20 | 0.40 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
| ▸ | PTK2 | Q05397 | 4/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | MAP4K1 | Q92918 | 3/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23154090 | 0.90 | INSR (0.49) | ALKINSRIGF1RCDK7CDK9 | |
| SCHEMBL23153875 | 0.88 | EGFR (0.42) | ALKINSRIGF1RCDK7CDK9 | |
| SCHEMBL29975976 | 0.88 | EGFR (0.42) | ALKINSRIGF1RCDK7CDK9 | |
| SCHEMBL24179108 | 0.84 | ALK (0.39) | ALKINSRIGF1RCDK7CDK9 | |
| SCHEMBL30503695 | 0.84 | CDK7 (0.48) | ALKINSRIGF1RCDK7CDK9 | |
| SCHEMBL14240767 | 0.84 | CDK7 (0.48) | ALKINSRIGF1RCDK7CDK9 | |
| SCHEMBL23153959 | 0.84 | PTK2 (0.38) | ALKINSRIGF1RCDK7CDK9 | |
| SCHEMBL23153853 | 0.80 | EGFR (0.40) | ALKINSRIGF1RCDK7CDK9 | |
| SCHEMBL23153842 | 0.77 | EGFR (0.38) | ALKINSRIGF1RCDK7CDK9 | |
| SCHEMBL30741156 | 0.76 | ALK (0.46) | ALKINSRIGF1RCDK7CDK9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021057882-A1 | EGFR INHIBITOR, COMPOSITION AND PREPARATION METHOD THEREFOR | 贝达药业股份有限公司 | 2021-04-01 | — | — | WO | disclosed |