Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 5/20 | 0.43 |
| ▸ | EDNRA | P25101 | 2/20 | 0.43 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | ICMT | O60725 | 2/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.33 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | WEE1 | P30291 | 1/20 | 0.32 |
| ▸ | TSPO | P30536 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL8547200 | 0.93 | EDNRB (0.45) | EDNRBEDNRAPLA2G2AMEN1TP53 | |
| SCHEMBL8549812 | 0.92 | EDNRB (0.41) | EDNRBEDNRAPTGES2PTGESICMT | |
| SCHEMBL8553149 | 0.89 | EDNRB (0.52) | EDNRBEDNRAPTGES2PTGESICMT | |
| SCHEMBL8549580 | 0.89 | EDNRB (0.54) | EDNRBEDNRAPLA2G2AMAPT | |
| SCHEMBL8624245 | 0.88 | EDNRB (0.43) | EDNRBEDNRAICMT | |
| SCHEMBL8549602 | 0.86 | EDNRB (0.46) | EDNRBEDNRAPTGES2PTGESICMT | |
| SCHEMBL8549027 | 0.86 | EDNRB (0.49) | EDNRBEDNRAPLA2G2AMAPTKMT2A | |
| SCHEMBL8550966 | 0.86 | EDNRB (0.43) | EDNRBEDNRAPLA2G2A | |
| SCHEMBL8549391 | 0.85 | EDNRB (0.44) | EDNRBEDNRAPLA2G2AMEN1TP53 | |
| SCHEMBL8551994 | 0.84 | EDNRB (0.42) | EDNRBEDNRA |
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 |