Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSV | O60911 | 3/20 | 0.52 |
| ▸ | CTSL | P07711 | 3/20 | 0.52 |
| ▸ | ERN1 | O75460 | 1/20 | 0.45 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
| ▸ | EDNRB | P24530 | 1/20 | 0.41 |
| ▸ | EDNRA | P25101 | 1/20 | 0.41 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.40 |
| ▸ | TUBB | P07437 | 1/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 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 | |
|---|---|---|---|---|
| SCHEMBL8551025 | 0.90 | GAA (0.44) | ERN1HPGDSMN1; SMN2NPC1TUBB4A | |
| SCHEMBL8553266 | 0.86 | EDNRB (0.56) | CTSVCTSLSRD5A1SRD5A2EDNRB | |
| SCHEMBL8549519 | 0.86 | KDM4E (0.38) | HPGDPDE4BTUBB4ATUBBTUBA3C | |
| SCHEMBL8546890 | 0.84 | EDNRB (0.44) | CTSVCTSLERN1SRD5A1SRD5A2 | |
| SCHEMBL8594175 | 0.84 | ALDH1A1 (0.39) | HPGDSMN1; SMN2TUBB4ATUBBTUBA3C | |
| SCHEMBL8552296 | 0.81 | PDE4B (0.42) | HPGDPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8549511 | 0.81 | KDM4E (0.40) | EDNRBHPGDSMN1; SMN2NPC1RAB9A | |
| SCHEMBL8550982 | 0.79 | CTSV (0.44) | CTSVCTSLSRD5A1SRD5A2HPGD | |
| SCHEMBL8553124 | 0.79 | GABRA1 (0.43) | ERN1EDNRBHPGDNPC1RAB9A | |
| SCHEMBL8547873 | 0.76 | EDNRB (0.46) | CTSVCTSLEDNRBEDNRAPDE4A |
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 |