Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 15/20 | 0.33 |
| ▸ | EDNRA | P25101 | 15/20 | 0.33 |
| ▸ | CASR | P41180 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.31 |
| ▸ | STING1 | Q86WV6 | 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 | |
|---|---|---|---|---|
| SCHEMBL5186385 | 0.89 | EDNRB (0.32) | EDNRBEDNRA | |
| SCHEMBL5259046 | 0.87 | EDNRB (0.36) | EDNRBEDNRAKDM4EALDH1A1 | |
| SCHEMBL5313941 | 0.85 | EDNRB (0.34) | EDNRBEDNRAKDM4EALDH1A1 | |
| SCHEMBL4694873 | 0.75 | NR1D1 (0.34) | MTNR1AMTNR1B | |
| SCHEMBL4693024 | 0.72 | — | — | |
| SCHEMBL5255513 | 0.69 | CASR (0.43) | CASRALDH1A1 | |
| SCHEMBL5252254 | 0.69 | KDM4E (0.39) | EDNRBEDNRAKDM4EALDH1A1MTNR1A | |
| SCHEMBL24326337 | 0.68 | REN (0.37) | CASRALDH1A1 | |
| SCHEMBL4145065 | 0.67 | NR1D1 (0.33) | ALDH1A1MTNR1AMTNR1B | |
| SCHEMBL899172 | 0.64 | KDM4E (0.40) | EDNRBEDNRACASRKDM4EALDH1A1 |
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-1399444-B1 | NOVEL HETEROCYCLIC COMPOUNDS, METHOD FOR PREPARING SAME AND USE THEREOF AS MEDICINES, IN PARTICULAR AS ANTI-BACTERIAL AGENTS | NOVEXEL (FR) | 2007-04-11 | — | — | EP | disclosed |