Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.51 |
| ▸ | NTRK1 | P04629 | 16/20 | 0.39 |
| ▸ | JAK2 | O60674 | 9/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.35 |
| ▸ | ROS1 | P08922 | 2/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | CETP | P11597 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30172470 | 0.88 | AAK1 (0.50) | AAK1NTRK1JAK2JAK3PTK2 | |
| SCHEMBL30172440 | 0.87 | AAK1 (0.55) | AAK1NTRK1JAK2JAK3PTK2 | |
| SCHEMBL17099735 | 0.83 | AAK1 (0.72) | AAK1NTRK1JAK2JAK3PTK2 | |
| SCHEMBL29398697 | 0.83 | AAK1 (0.72) | AAK1NTRK1JAK2JAK3PTK2 | |
| SCHEMBL30172452 | 0.81 | AAK1 (0.55) | AAK1NTRK1JAK2JAK3PTK2 | |
| SCHEMBL30172448 | 0.80 | AAK1 (0.58) | AAK1NTRK1JAK2JAK3PTK2 | |
| SCHEMBL30172443 | 0.80 | AAK1 (0.58) | AAK1NTRK1JAK2JAK3PTK2 | |
| SCHEMBL30172478 | 0.79 | AAK1 (0.57) | AAK1NTRK1JAK2JAK3PTK2 | |
| SCHEMBL30172413 | 0.78 | AAK1 (0.56) | AAK1NTRK1JAK2JAK3PTK2 | |
| SCHEMBL17099736 | 0.77 | AAK1 (0.59) | AAK1NTRK1JAK2JAK3PTK2 |
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-115677705-A | AAK1 inhibitor and application thereof | 武汉人福创新药物研发中心有限公司 | 2023-02-03 | — | — | CN | disclosed |