Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.48 |
| ▸ | AXL | P30530 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 8/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 4/20 | 0.33 |
| ▸ | CDK2 | P24941 | 4/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.33 |
| ▸ | PLK4 | O00444 | 3/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 3/20 | 0.33 |
| ▸ | DYRK3 | O43781 | 3/20 | 0.33 |
| ▸ | CDK1 | P06493 | 3/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.33 |
| ▸ | MARK3 | P27448 | 3/20 | 0.33 |
| ▸ | TYK2 | P29597 | 3/20 | 0.33 |
| ▸ | CLK2 | P49760 | 3/20 | 0.33 |
| ▸ | JAK3 | P52333 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30833653 | 0.80 | MAPT (0.48) | CDK2KDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL9229130 | 0.79 | KDM4E (0.39) | GPR84PDPK1KDM4EMEN1ALDH1A1 | |
| SCHEMBL29643965 | 0.78 | GSK3B (0.59) | GSK3BAXLHTR2AHTR2CHTR2B | |
| SCHEMBL22890815 | 0.78 | GSK3B (0.59) | GSK3BAXLHTR2AHTR2CHTR2B | |
| SCHEMBL19308820 | 0.69 | KDM4E (0.43) | GPR84PDPK1KDM4EALDH1A1GAA | |
| SCHEMBL3352618 | 0.68 | GSK3B (0.51) | GSK3BAXLHTR2AHTR2CHTR2B | |
| SCHEMBL27525500 | 0.67 | OPRM1 (0.36) | GPR84KDM4EMEN1ALDH1A1GAA | |
| SCHEMBL23067968 | 0.67 | PDPK1 (0.47) | GSK3BAXLHTR2AHTR2CHTR2B | |
| SCHEMBL23068049 | 0.67 | PDPK1 (0.47) | GSK3BAXLHTR2AHTR2CHTR2B | |
| SCHEMBL118573 | 0.67 | JAK2 (0.64) | GSK3BAXLHTR2AHTR2CHTR2B |
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 |