Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAP4K4 | O95819 | 5/20 | 0.49 |
| ▸ | GBA1 | P04062 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | JAK2 | O60674 | 2/20 | 0.43 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PI4KA | P42356 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL807273 | 0.97 | ALDH1A1 (0.53) | ALDH1A1MAP4K4GBA1GLAHPGD | |
| SCHEMBL790786 | 0.87 | ALDH1A1 (0.52) | ALDH1A1MAP4K4GBA1GLAHPGD | |
| SCHEMBL790788 | 0.82 | NPC1 (0.54) | JAK2JAK1JAK3 | |
| SCHEMBL790535 | 0.82 | PI4KA (0.41) | MAP4K4JAK2JAK1SYKPI4KA | |
| SCHEMBL789721 | 0.80 | MAPK14 (0.51) | ALDH1A1USP2SMN1; SMN2 | |
| SCHEMBL789511 | 0.79 | SMN1; SMN2 (0.59) | ALDH1A1POLBSMN1; SMN2PIK3CA | |
| SCHEMBL790646 | 0.78 | KDR (0.47) | ALDH1A1GBA1GLAHPGDHSD17B10 | |
| SCHEMBL789696 | 0.76 | JAK2 (0.48) | ALDH1A1HPGDJAK2SMN1; SMN2L3MBTL1 | |
| SCHEMBL789670 | 0.76 | PI4KA (0.51) | ALDH1A1SMN1; SMN2PI4KAPIK3CGPIK3CA | |
| SCHEMBL790553 | 0.73 | ATR (0.49) | JAK2JAK1SMN1; SMN2PI4KAPIK3CG |
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-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |