Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK3 | Q16288 | 13/20 | 0.57 |
| ▸ | NTRK1 | P04629 | 12/20 | 0.57 |
| ▸ | NTRK2 | Q16620 | 12/20 | 0.57 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.46 |
| ▸ | TTBK1 | Q5TCY1 | 2/20 | 0.45 |
| ▸ | TTBK2 | Q6IQ55 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 3/20 | 0.44 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28501624 | 0.77 | NTRK3 (0.71) | NTRK3NTRK1NTRK2 | |
| SCHEMBL28511513 | 0.75 | NTRK3 (0.68) | NTRK3NTRK1NTRK2 | |
| SCHEMBL28505742 | 0.74 | NTRK3 (0.73) | NTRK3NTRK1NTRK2 | |
| SCHEMBL28505375 | 0.74 | NTRK3 (0.65) | NTRK3NTRK1NTRK2 | |
| SCHEMBL28960370 | 0.73 | NTRK3 (1.00) | NTRK3NTRK1NTRK2 | |
| SCHEMBL28503859 | 0.71 | NTRK3 (0.63) | NTRK3NTRK1NTRK2 | |
| SCHEMBL31459775 | 0.70 | NTRK3 (0.43) | NTRK3NTRK1NTRK2 | |
| SCHEMBL10955808 | 0.70 | ABCG2 (0.54) | ABCG2TTBK1TTBK2EGFRALK | |
| SCHEMBL4923454 | 0.69 | TTBK1 (0.56) | ABCG2TTBK1TTBK2EGFRALK | |
| SCHEMBL4923460 | 0.69 | ROCK1 (0.64) | TTBK1TTBK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116410203-B | Compound with TRK and drug-resistant mutation inhibition activity and application thereof | 四川大学 | 2024-06-25 | — | — | CN | disclosed |
| CN-116410203-A | Compound with TRK and drug-resistant mutation inhibition activity and application thereof | 四川大学 | 2023-07-11 | — | — | CN | disclosed |