Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 7/20 | 0.67 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | EDNRB | P24530 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.47 |
| ▸ | ACLY | P53396 | 1/20 | 0.45 |
| ▸ | TYMS | P04818 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12793182 | 0.90 | GAA (0.60) | EDNRAGAAKDM4ELMNANPSR1 | |
| SCHEMBL8395655 | 0.83 | EDNRA (0.67) | EDNRAHCRTR1EDNRBTSHRPGR | |
| SCHEMBL8394286 | 0.83 | HCRTR1 (0.49) | EDNRAHCRTR1EDNRBTSHRPGR | |
| SCHEMBL8394226 | 0.81 | EDNRA (0.70) | EDNRALMNAHCRTR1EDNRBTSHR | |
| SCHEMBL8055525 | 0.80 | EDNRA (1.00) | EDNRAKDM4ETSHR | |
| SCHEMBL8391081 | 0.80 | EDNRA (0.70) | EDNRAHCRTR1EDNRBTSHRPGR | |
| SCHEMBL8395646 | 0.80 | HCRTR1 (0.49) | EDNRAHCRTR1EDNRBTSHRPGR | |
| SCHEMBL8393188 | 0.80 | HCRTR1 (0.46) | EDNRAHCRTR1PKMEDNRBTSHR | |
| SCHEMBL7764513 | 0.79 | EDNRA (0.67) | EDNRAKDM4ELMNAHCRTR1PKM | |
| SCHEMBL8394279 | 0.79 | EDNRA (0.67) | EDNRAHCRTR1PKMEDNRBTSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0752986-B1 | N-HETEROCYCLYL SULPHONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS | ZENECA LTD (GB) | 1999-05-19 | — | — | EP | disclosed |