Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 9/20 | 0.63 |
| ▸ | MET | P08581 | 3/20 | 0.63 |
| ▸ | EGFR | P00533 | 3/20 | 0.51 |
| ▸ | AXL | P30530 | 6/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.47 |
| ▸ | NEK2 | P51955 | 1/20 | 0.47 |
| ▸ | INSR | P06213 | 3/20 | 0.47 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.47 |
| ▸ | FLT3 | P36888 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29190681 | 1.00 | ALK (0.63) | ALKMETEGFRAXLAURKA | |
| SCHEMBL30833727 | 0.81 | ALK (0.47) | ALKMETEGFRAXLAURKA | |
| SCHEMBL30429763 | 0.81 | CDK2 (0.47) | ALKEGFRAXL | |
| SCHEMBL29833077 | 0.80 | EGFR (0.62) | ALKEGFRINSRPTK2 | |
| SCHEMBL28996874 | 0.80 | EGFR (0.62) | ALKEGFRINSRPTK2 | |
| SCHEMBL21432463 | 0.80 | AXL (0.73) | ALKMETEGFRAXLAURKA | |
| SCHEMBL25233510 | 0.79 | AURKA (0.67) | ALKMETEGFRAXLAURKA | |
| SCHEMBL21432456 | 0.78 | EGFR (0.71) | ALKMETEGFRAXLNEK2 | |
| SCHEMBL25284886 | 0.78 | ALK (0.65) | ALKMETEGFRAURKAAURKB | |
| SCHEMBL29190658 | 0.78 | ALK (0.59) | ALKMETEGFRFLT3 |
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-113896744-B | Selective EGFR inhibitor | 成都先导药物开发股份有限公司 | 2024-04-16 | — | — | CN | disclosed |