Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TOP1 | P11387 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 13/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | FOXO1 | Q12778 | 1/20 | 0.37 |
| ▸ | TOP2A | P11388 | 1/20 | 0.35 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9044750 | 0.88 | ALDH1A1 (0.41) | ALDH1A1HTTTOP1GSK3BSTAT3 | |
| SCHEMBL9047564 | 0.87 | ALDH1A1 (0.40) | ALDH1A1HTTTOP1GSK3BSTAT3 | |
| SCHEMBL9047265 | 0.87 | ALDH1A1 (0.40) | ALDH1A1HTTTOP1GSK3BSTAT3 | |
| SCHEMBL9047636 | 0.85 | HTT (0.46) | ALDH1A1HTTSTAT3KDM4E | |
| SCHEMBL9047248 | 0.83 | ALDH1A1 (0.40) | ALDH1A1HTTTOP1STAT3TOP2A | |
| SCHEMBL9045282 | 0.81 | LMNA (0.43) | ALDH1A1HTTTOP1GSK3BTOP2A | |
| SCHEMBL9045574 | 0.80 | KCNH2 (0.38) | ALDH1A1HTTTOP1GSK3BFOXO1 | |
| SCHEMBL9046944 | 0.76 | ALDH1A1 (0.53) | ALDH1A1HTTTOP1STAT3TOP2A | |
| SCHEMBL9048884 | 0.75 | GSK3B (0.35) | GSK3BFOXO1POLB | |
| SCHEMBL9048876 | 0.74 | SLC2A1 (0.36) | GSK3BFOXO1TOP2ATOP2BPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0700912-A1 | QUINOLONE DERIVATIVE OR SALT THEREOF, AND ANTIBACTERIAL CONTAINING THE SAME | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1996-03-13 | — | — | EP | disclosed |