Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.52 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.52 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.46 |
| ▸ | RPS6KA5 | O75582 | 3/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.46 |
| ▸ | PRKACA | P17612 | 3/20 | 0.46 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.46 |
| ▸ | AKT1 | P31749 | 3/20 | 0.46 |
| ▸ | GSK3A | P49840 | 3/20 | 0.46 |
| ▸ | PRKX | P51817 | 3/20 | 0.46 |
| ▸ | PRKCD | Q05655 | 3/20 | 0.46 |
| ▸ | PRKG2 | Q13237 | 3/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.46 |
| ▸ | PRKG1 | Q13976 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10585776 | 0.87 | ALDH1A1 (0.60) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| SCHEMBL10886301 | 0.87 | GSK3B (0.70) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Hydrochloric Acid SCHEMBL4898869 | 0.85 | ALDH1A1 (0.58) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| SCHEMBL25139837 | 0.80 | MAPT (0.66) | GSK3BHDAC1HDAC6ALDH1A1MAPK1 | |
| SCHEMBL11480265 | 0.80 | GSK3B (0.80) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| SCHEMBL25224307 | 0.79 | GSK3B (0.87) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| SCHEMBL3791851 | 0.79 | ALDH1A1 (0.75) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Bromide SCHEMBL9203773 | 0.78 | GSK3B (0.63) | GSK3BHDAC1HDAC6ALDH1A1MAPK1 | |
| SCHEMBL10375232 | 0.78 | ALDH1A1 (0.47) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| SCHEMBL10144854 | 0.78 | HAO1 (0.59) | GSK3BHDAC1HDAC6ALDH1A1MAPK1 |
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-0154780-A1 | Quinoline antibacterial compounds | ABBOTT LABORATORIES (US) | 1985-09-18 | — | — | EP | disclosed |