Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 5/20 | 0.72 |
| ▸ | EGFR | P00533 | 4/20 | 0.63 |
| ▸ | GAK | O14976 | 3/20 | 0.55 |
| ▸ | FADS1 | O60427 | 1/20 | 0.49 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.48 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | RET | P07949 | 1/20 | 0.46 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19633642 | 0.89 | EGFR (0.71) | ALKEGFRGAKFADS1TGFBR1 | |
| SCHEMBL19633640 | 0.89 | GAK (0.60) | ALKEGFRGAKFADS1TGFBR1 | |
| SCHEMBL19633717 | 0.89 | ALK (0.81) | ALKEGFRGAKFADS1PKMYT1 | |
| SCHEMBL19633680 | 0.84 | FADS1 (0.63) | GAKFADS1 | |
| SCHEMBL31167325 | 0.84 | PKMYT1 (0.60) | ALKEGFRGAKFADS1TGFBR1 | |
| SCHEMBL19633659 | 0.84 | ALK (0.72) | ALKEGFRGAKFADS1PKMYT1 | |
| SCHEMBL19633677 | 0.81 | ALK (0.67) | ALKEGFRGAKKDRRET | |
| SCHEMBL19633632 | 0.81 | GAK (0.62) | EGFRGAKTGFBR1 | |
| SCHEMBL17075805 | 0.79 | EGFR (0.74) | EGFRGAK | |
| SCHEMBL19633636 | 0.79 | FBP1 (0.51) | ALKEGFRGAKFADS1TGFBR1 |
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-2017198196-A1 | QUINOLINE DERIVATIVE HAVING ANTI-TUMOR ACTIVITY | 王子厚 | 2017-11-23 | — | — | WO | disclosed |