Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 15/20 | 1.00 |
| ▸ | GRK6 | P43250 | 6/20 | 0.78 |
| ▸ | NTRK3 | Q16288 | 4/20 | 0.70 |
| ▸ | NTRK2 | Q16620 | 4/20 | 0.70 |
| ▸ | AURKA | O14965 | 2/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL25819035 | 0.90 | NTRK1 (0.82) | NTRK1GRK6NTRK3NTRK2 | |
| SCHEMBL25818960 | 0.90 | NTRK1 (1.00) | NTRK1NTRK3NTRK2 | |
| SCHEMBL25819022 | 0.88 | NTRK1 (1.00) | NTRK1GRK6AURKA | |
| SCHEMBL25819060 | 0.85 | NTRK1 (1.00) | NTRK1NTRK3NTRK2 | |
| SCHEMBL12430736 | 0.83 | GRK6 (0.76) | NTRK1GRK6AURKA | |
| SCHEMBL25819015 | 0.83 | NTRK1 (1.00) | NTRK1NTRK3NTRK2 | |
| SCHEMBL25818941 | 0.82 | NTRK1 (1.00) | NTRK1NTRK3NTRK2 | |
| SCHEMBL25819192 | 0.82 | NTRK1 (1.00) | NTRK1NTRK3NTRK2 | |
| SCHEMBL25818933 | 0.82 | NTRK1 (1.00) | NTRK1NTRK3NTRK2AURKA | |
| SCHEMBL25819071 | 0.82 | NTRK1 (1.00) | NTRK1NTRK3NTRK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023123883-A1 | METHOD FOR PREPARING QUINAZOLINE DERIVATIVE AND ANALOG THEREOF AND USE THEREOF | 沈阳药科大学 | 2023-07-06 | — | — | WO | disclosed |