Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 6/20 | 0.68 |
| ▸ | ULK1 | O75385 | 1/20 | 0.50 |
| ▸ | CDK2 | P24941 | 2/20 | 0.48 |
| ▸ | CDK1 | P06493 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | ZAP70 | P43403 | 6/20 | 0.47 |
| ▸ | CDK19 | Q9BWU1 | 3/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | PAK4 | O96013 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | PRKACA | P17612 | 1/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.46 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.46 |
| ▸ | CDK8 | P49336 | 1/20 | 0.46 |
| ▸ | CLK2 | P49760 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29190525 | 1.00 | ALK (0.68) | ALKULK1CDK2CDK1KDR | |
| SCHEMBL31251329 | 0.93 | ALK (0.68) | ALKULK1CDK2CDK1KDR | |
| SCHEMBL29190577 | 0.90 | ALK (0.55) | ALKULK1CDK7CDK9PTK2 | |
| SCHEMBL30833646 | 0.90 | ALK (0.55) | ALKULK1CDK7CDK9PTK2 | |
| SCHEMBL29190704 | 0.85 | ALK (0.49) | ALKCDK2CDK1KDRCDK19 | |
| SCHEMBL30833810 | 0.85 | ALK (0.49) | ALKCDK2CDK1KDRCDK19 | |
| SCHEMBL31251169 | 0.84 | ALK (0.62) | ALKULK1CDK2CDK1KDR | |
| SCHEMBL31251390 | 0.84 | ALK (0.65) | ALKULK1CDK2CDK1KDR | |
| SCHEMBL29190613 | 0.83 | ALK (0.49) | ALKCDK2CDK19CDC7DAPK3 | |
| SCHEMBL30833747 | 0.83 | ALK (0.49) | ALKCDK2CDK19CDC7DAPK3 |
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 |