Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 5/20 | 0.40 |
| ▸ | EDNRA | P25101 | 3/20 | 0.38 |
| ▸ | PDE5A | O76074 | 2/20 | 0.36 |
| ▸ | PDE4A | P27815 | 2/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8551981 | 0.94 | EDNRB (0.42) | EDNRBEDNRAPDE4APDE4BPDE4C | |
| SCHEMBL8549255 | 0.93 | EDNRB (0.47) | EDNRBEDNRAALDH1A1MDM2TSHR | |
| SCHEMBL8548409 | 0.90 | EDNRB (0.41) | EDNRBEDNRAKDM4EMDM2GABRA1 | |
| SCHEMBL8619717 | 0.89 | EDNRB (0.40) | EDNRBEDNRAKDM4EMDM2GABRA1 | |
| SCHEMBL8551615 | 0.86 | EDNRB (0.45) | EDNRBEDNRAPDE5APDE4APDE4B | |
| SCHEMBL8547873 | 0.85 | EDNRB (0.46) | EDNRBEDNRAPDE4APDE4BPDE4C | |
| SCHEMBL8549140 | 0.85 | EDNRB (0.48) | EDNRBEDNRATSHRTDP1DYRK1A | |
| SCHEMBL8548607 | 0.83 | EDNRB (0.45) | EDNRBEDNRAKDM4EDYRK1APDCD1 | |
| SCHEMBL8551108 | 0.82 | EDNRB (0.50) | EDNRBEDNRADYRK1APLA2G2A | |
| SCHEMBL8551478 | 0.81 | EDNRB (0.48) | EDNRBEDNRAKDM4EALDH1A1LMNA |
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 |