Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GBA2 | Q9HCG7 | 2/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16980418 | 0.89 | KCNK3 (0.36) | S1PR1S1PR3S1PR5HRH3 | |
| SCHEMBL9340450 | 0.86 | S1PR1 (0.40) | S1PR1S1PR3S1PR5CYP3A4CYP2D6 | |
| SCHEMBL2113722 | 0.84 | HRH3 (0.34) | S1PR1S1PR3S1PR5HRH3 | |
| SCHEMBL2113723 | 0.84 | GBA1 (0.34) | HRH3 | |
| SCHEMBL13416594 | 0.82 | HRH3 (0.39) | TSHRHRH3 | |
| SCHEMBL9891853 | 0.82 | HRH3 (0.39) | TSHRHRH3 | |
| SCHEMBL23318900 | 0.81 | SLC6A9 (0.34) | S1PR1S1PR3S1PR5S1PR4 | |
| SCHEMBL27282041 | 0.80 | L3MBTL1 (0.36) | HRH3 | |
| SCHEMBL12595521 | 0.80 | L3MBTL1 (0.36) | HRH3 | |
| SCHEMBL2113628 | 0.78 | HRH3 (0.37) | S1PR1S1PR3S1PR5S1PR4HRH3 |
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-2017210685-A1 | PYRADAZINONE DERIVATIVES AND THE COMPOSITIONS AND METHODS OF TREATMENT REGARDING THE SAME | An2H Discovery Limited (IE) | 2017-12-07 | — | — | WO | disclosed |