Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 9/20 | 0.52 |
| ▸ | FLT3 | P36888 | 2/20 | 0.52 |
| ▸ | ROS1 | P08922 | 2/20 | 0.47 |
| ▸ | EGFR | P00533 | 6/20 | 0.46 |
| ▸ | BRD4 | O60885 | 2/20 | 0.44 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.41 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29190605 | 0.88 | ALK (0.67) | ALKFLT3ROS1EGFRBRD4 | |
| SCHEMBL29190535 | 0.86 | ALK (0.53) | ALKFLT3ROS1EGFRBRD4 | |
| SCHEMBL29190702 | 0.86 | ALK (0.53) | ALKFLT3ROS1EGFRBRD4 | |
| SCHEMBL29190602 | 0.85 | ALK (0.53) | ALKFLT3ROS1EGFRBRD4 | |
| SCHEMBL29190617 | 0.81 | ALK (0.68) | ALKFLT3EGFR | |
| SCHEMBL29190646 | 0.77 | ALK (0.47) | ALKFLT3ROS1EGFRBRD4 | |
| SCHEMBL29190656 | 0.75 | BRD4 (0.57) | ALKFLT3ROS1EGFRBRD4 | |
| SCHEMBL29190626 | 0.74 | EGFR (0.52) | ALKFLT3EGFR | |
| SCHEMBL29190585 | 0.74 | CDK9 (0.54) | ALKFLT3EGFRMAP3K7MAPK1 | |
| SCHEMBL29190551 | 0.73 | ALK (0.67) | ALKFLT3EGFRGLO1 |
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 |