Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 7/20 | 0.47 |
| ▸ | INSR | P06213 | 3/20 | 0.47 |
| ▸ | MET | P08581 | 4/20 | 0.46 |
| ▸ | CDK9 | P50750 | 3/20 | 0.45 |
| ▸ | AURKA | O14965 | 2/20 | 0.45 |
| ▸ | NEK2 | P51955 | 2/20 | 0.45 |
| ▸ | CDC7 | O00311 | 2/20 | 0.45 |
| ▸ | JAK2 | O60674 | 2/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.45 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.45 |
| ▸ | PAK4 | O96013 | 2/20 | 0.45 |
| ▸ | PRKACA | P17612 | 2/20 | 0.45 |
| ▸ | CLK2 | P49760 | 2/20 | 0.45 |
| ▸ | GSK3A | P49840 | 2/20 | 0.45 |
| ▸ | CDK7 | P50613 | 2/20 | 0.45 |
| ▸ | PRKX | P51817 | 2/20 | 0.45 |
| ▸ | CAMK2D | Q13557 | 2/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.45 |
| ▸ | MELK | Q14680 | 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 | |
|---|---|---|---|---|
| SCHEMBL30833714 | 0.84 | ALK (0.46) | ALKINSRMETCDK9AURKA | |
| SCHEMBL30833642 | 0.81 | ALK (0.63) | ALKINSRMETAURKANEK2 | |
| SCHEMBL29190681 | 0.81 | ALK (0.63) | ALKINSRMETAURKANEK2 | |
| SCHEMBL30429763 | 0.81 | CDK2 (0.47) | ALKCDK9CDC7JAK2ROCK2 | |
| SCHEMBL28996874 | 0.80 | EGFR (0.62) | ALKINSRPTK2EGFRIGF1R | |
| SCHEMBL29833077 | 0.80 | EGFR (0.62) | ALKINSRPTK2EGFRIGF1R | |
| SCHEMBL30833783 | 0.78 | SYK (0.47) | ALKMETCDK9CDC7JAK2 | |
| SCHEMBL30833667 | 0.78 | KDR (0.48) | CDK9CDC7JAK2ROCK2MAP4K4 | |
| SCHEMBL29190658 | 0.76 | ALK (0.59) | ALKMETFLT3EGFRROS1 | |
| SCHEMBL31251206 | 0.73 | EGFR (0.63) | ALKINSRPTK2EGFRIGF1R |
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 |