Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 12/20 | 0.52 |
| ▸ | EDNRA | P25101 | 9/20 | 0.52 |
| ▸ | CCR2 | P41597 | 2/20 | 0.37 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | ICMT | O60725 | 1/20 | 0.34 |
| ▸ | SERPINE1 | P05121 | 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 | |
|---|---|---|---|---|
| SCHEMBL8547198 | 0.93 | EDNRB (0.55) | EDNRBEDNRA | |
| SCHEMBL8553153 | 0.89 | EDNRB (0.43) | EDNRBEDNRACCR2PTGES2PTGES | |
| SCHEMBL8549579 | 0.88 | EDNRB (0.68) | EDNRBEDNRASERPINE1 | |
| SCHEMBL8624241 | 0.87 | EDNRB (0.52) | EDNRBEDNRACCR2 | |
| SCHEMBL8549596 | 0.86 | EDNRB (0.57) | EDNRBEDNRACCR2PTGES2PTGES | |
| SCHEMBL8549812 | 0.86 | EDNRB (0.41) | EDNRBEDNRAPTGES2PTGESICMT | |
| SCHEMBL8549025 | 0.86 | EDNRB (0.62) | EDNRBEDNRASERPINE1 | |
| SCHEMBL8550963 | 0.85 | EDNRB (0.54) | EDNRBEDNRASERPINE1 | |
| SCHEMBL8550814 | 0.83 | EDNRB (0.53) | EDNRBEDNRACCR2 | |
| SCHEMBL8551991 | 0.83 | EDNRB (0.52) | EDNRBEDNRASERPINE1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0863898-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK PATENT GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997019077-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1997-05-29 | — | — | WO | disclosed |