Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAK | O14976 | 3/20 | 0.57 |
| ▸ | APP | P05067 | 1/20 | 0.54 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.54 |
| ▸ | GSK3A | P49840 | 3/20 | 0.48 |
| ▸ | GSK3B | P49841 | 3/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.48 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.48 |
| ▸ | MST1R | Q04912 | 1/20 | 0.48 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.47 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.47 |
| ▸ | EPHA1 | P21709 | 1/20 | 0.47 |
| ▸ | EPHA8 | P29322 | 1/20 | 0.47 |
| ▸ | TXK | P42681 | 1/20 | 0.47 |
| ▸ | COQ8A | Q8NI60 | 1/20 | 0.47 |
| ▸ | NLK | Q9UBE8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29200458 | 0.82 | GAK (0.64) | GAKGSK3AGSK3BCLK4EPHB6 | |
| SCHEMBL28845692 | 0.82 | FADS1 (0.66) | GAKAPPNR4A2GSK3AGSK3B | |
| SCHEMBL28845712 | 0.82 | EGFR (0.66) | GAKGSK3AGSK3BCLK4EPHB6 | |
| SCHEMBL28845637 | 0.80 | DNMT1 (0.52) | GAKGSK3AGSK3BCLK4ACVR1 | |
| SCHEMBL29200469 | 0.80 | GAK (0.55) | GAKGSK3AGSK3BCLK4ACVR1 | |
| SCHEMBL11553078 | 0.79 | KDM4E (0.50) | GAKAPPMAPKAPK2 | |
| SCHEMBL28845634 | 0.79 | GAK (0.55) | GAKGSK3AGSK3BCLK4ACVR1 | |
| SCHEMBL28845679 | 0.79 | GAK (0.50) | GAKAPPNR4A2GSK3AGSK3B | |
| SCHEMBL29089850 | 0.78 | GAK (0.65) | GAKGSK3AGSK3BCLK4EPHB6 | |
| SCHEMBL11557265 | 0.78 | MAPKAPK2 (0.47) | GAKMAPKAPK2 |
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-114773267-B | [ (7-trifluoromethyl quinoline-4-yl) amino ] benzamide compound and preparation and application thereof | 沈阳药科大学 | 2024-01-26 | — | — | CN | claimed |