Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 5/20 | 0.43 |
| ▸ | EDNRA | P25101 | 2/20 | 0.41 |
| ▸ | AGTR2 | P50052 | 4/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8624245 | 0.94 | EDNRB (0.43) | EDNRBEDNRAAGTR2AGTR1S1PR1 | |
| SCHEMBL8552575 | 0.92 | EDNRB (0.40) | EDNRBEDNRAAGTR2AGTR1 | |
| SCHEMBL8549515 | 0.92 | EDNRB (0.47) | EDNRBEDNRAAGTR2AGTR1 | |
| SCHEMBL8551305 | 0.90 | EDNRB (0.47) | EDNRBEDNRAAGTR2AGTR1 | |
| SCHEMBL8550814 | 0.90 | EDNRB (0.53) | EDNRBEDNRAAGTR2AGTR1 | |
| SCHEMBL8553553 | 0.90 | EDNRB (0.36) | EDNRBEDNRAAGTR2AGTR1 | |
| SCHEMBL8591727 | 0.88 | EDNRB (0.56) | EDNRBEDNRAAGTR2 | |
| SCHEMBL8551995 | 0.88 | EDNRB (0.41) | EDNRBEDNRAAGTR2AGTR1PTGES2 | |
| SCHEMBL8552260 | 0.86 | EDNRB (0.47) | EDNRBEDNRAAGTR2AGTR1 | |
| SCHEMBL8552857 | 0.86 | EDNRB (0.40) | EDNRBEDNRAAGTR2AGTR1 |
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 |