Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 10/20 | 0.53 |
| ▸ | EDNRA | P25101 | 7/20 | 0.53 |
| ▸ | CLK1 | P49759 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL8552822 | 0.95 | EDNRB (0.58) | EDNRBEDNRACLK1NPC1RAB9A | |
| SCHEMBL8548007 | 0.92 | EDNRB (0.58) | EDNRBEDNRAHCRTR1HCRTR2ERN1 | |
| SCHEMBL8547839 | 0.90 | EDNRB (0.52) | EDNRBEDNRACLK1NPC1RAB9A | |
| SCHEMBL8548806 | 0.89 | EDNRB (0.53) | EDNRBEDNRACLK1NPC1RAB9A | |
| SCHEMBL8547910 | 0.89 | EDNRB (0.52) | EDNRBEDNRACLK1NPC1RAB9A | |
| SCHEMBL8552129 | 0.89 | EDNRB (0.63) | EDNRBEDNRA | |
| SCHEMBL8594151 | 0.87 | EDNRB (0.63) | EDNRBEDNRAHCRTR1HCRTR2ERN1 | |
| SCHEMBL8548004 | 0.87 | EDNRB (0.71) | EDNRBEDNRA | |
| SCHEMBL8549019 | 0.86 | EDNRB (0.49) | EDNRBEDNRAKMT2AP2RX3 | |
| SCHEMBL8552763 | 0.85 | EDNRB (0.47) | EDNRBEDNRAKDM4EKMT2A |
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 |