Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 12/20 | 0.56 |
| ▸ | EDNRA | P25101 | 11/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CTSV | O60911 | 2/20 | 0.44 |
| ▸ | CTSL | P07711 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8546850 | 0.91 | KDM4E (0.52) | EDNRBEDNRAKDM4EKMT2AMEN1 | |
| SCHEMBL8546890 | 0.88 | EDNRB (0.44) | EDNRBEDNRAKDM4EKMT2AMEN1 | |
| SCHEMBL8552298 | 0.86 | EDNRA (0.53) | EDNRBEDNRA | |
| SCHEMBL8551848 | 0.86 | CTSV (0.52) | EDNRBEDNRAKMT2AMEN1CTSV | |
| SCHEMBL8551756 | 0.78 | CLK1 (0.45) | EDNRBEDNRAKDM4EKMT2AMEN1 | |
| SCHEMBL8550982 | 0.76 | CTSV (0.44) | CTSVCTSLALDH1A1MAPTSRD5A1 | |
| SCHEMBL8547384 | 0.75 | EDNRB (0.54) | EDNRBEDNRAKDM4EKMT2AMEN1 | |
| SCHEMBL8546754 | 0.75 | NPC1 (0.40) | KDM4EKMT2AMEN1CYP1A2CYP3A4 | |
| SCHEMBL8551025 | 0.75 | GAA (0.44) | KDM4EKMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL8547598 | 0.74 | NPC1 (0.40) | EDNRBEDNRAKDM4EHSD17B10CTSV |
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 |