Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 7/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 5/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.30 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8552464 | 0.82 | ADORA2A (0.37) | HSD11B1ARALDH1A1 | |
| SCHEMBL8372826 | 0.79 | PLAU (0.39) | MAPK14ALDH1A1 | |
| SCHEMBL8551877 | 0.78 | ESR1 (0.37) | MAPK14GRM2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8552094 | 0.78 | PLAU (0.38) | MAPK14ALDH1A1 | |
| SCHEMBL8372825 | 0.77 | ENPP3 (0.33) | MAPK14HSP90AB1ALDH1A1 | |
| SCHEMBL8546629 | 0.75 | PARP1 (0.40) | PARP1 | |
| SCHEMBL28934596 | 0.75 | L3MBTL1 (0.37) | HSP90AB1ALDH1A1 | |
| SCHEMBL8549331 | 0.74 | HSD11B1 (0.42) | HSD11B1RXFP1ALDH1A1 | |
| SCHEMBL8548393 | 0.71 | HSD11B1 (0.44) | HSD11B1 | |
| SCHEMBL8549262 | 0.70 | ALDH1A1 (0.41) | ALDH1A1 |
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-0825187-A1 | Condensed pyridazinyl guanidines, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |