Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 18/20 | 0.65 |
| ▸ | EDNRA | P25101 | 16/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8552935 | 0.92 | EDNRB (0.60) | EDNRBEDNRAKDM4EALDH1A1LMNA | |
| SCHEMBL8552343 | 0.89 | EDNRB (0.51) | EDNRBEDNRAKDM4ELMNA | |
| SCHEMBL8547924 | 0.89 | EDNRB (0.56) | EDNRBEDNRA | |
| SCHEMBL8547840 | 0.88 | EDNRB (0.68) | EDNRBEDNRA | |
| SCHEMBL8551390 | 0.87 | EDNRB (0.53) | EDNRBEDNRAALDH1A1LMNA | |
| SCHEMBL8550952 | 0.84 | EDNRB (0.46) | EDNRBEDNRAKDM4EALDH1A1 | |
| SCHEMBL6313368 | 0.82 | EDNRB (0.94) | EDNRBEDNRA | |
| SCHEMBL8547910 | 0.81 | EDNRB (0.52) | EDNRBEDNRAKDM4E | |
| SCHEMBL8594151 | 0.81 | EDNRB (0.63) | EDNRBEDNRA | |
| SCHEMBL8547597 | 0.81 | EDNRB (0.47) | EDNRBEDNRAKDM4E |
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 |