Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 3/20 | 0.42 |
| ▸ | EDNRA | P25101 | 3/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 8/20 | 0.37 |
| ▸ | PPARG | P37231 | 6/20 | 0.37 |
| ▸ | PTGES | O14684 | 4/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL9050654 | 0.88 | EDNRB (0.39) | EDNRBEDNRA | |
| SCHEMBL9051577 | 0.82 | EDNRB (0.40) | EDNRBEDNRAALDH1A1 | |
| SCHEMBL9051600 | 0.81 | EDNRB (0.40) | EDNRBEDNRAALDH1A1 | |
| SCHEMBL9052951 | 0.79 | EDNRB (0.39) | EDNRBEDNRA | |
| Imidazole SCHEMBL9050394 | 0.78 | EDNRB (0.33) | EDNRBEDNRA | |
| SCHEMBL9050809 | 0.77 | EDNRB (0.63) | EDNRBEDNRA | |
| SCHEMBL9588704 | 0.77 | EDNRB (0.41) | EDNRBEDNRAALDH1A1 | |
| SCHEMBL9051237 | 0.75 | ALDH1A1 (0.33) | EDNRBEDNRAALDH1A1 | |
| SCHEMBL8943560 | 0.74 | ALDH1A1 (0.41) | EDNRBEDNRAADORA3ADORA1ALDH1A1 | |
| SCHEMBL8943529 | 0.74 | EDNRB (0.37) | EDNRBEDNRAALOX5PPARGPTGES |
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-1996000219-A1 | PYRIMIDINYL- AND TRIAZINYL-OXY AND THIO-3-HALOALKYL-PROPIONIC ACID DERIVATIVES AS HERBICIDES | CIBA-GEIGY AG (CH) | 1996-01-04 | — | — | WO | disclosed |