Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.49 |
| ▸ | EDNRA | P25101 | 9/20 | 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 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.43 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.43 |
| ▸ | RORA | P35398 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8394178 | 0.83 | EDNRA (0.67) | HCRTR1EDNRAEDNRBTSHRPGR | |
| SCHEMBL8395655 | 0.83 | EDNRA (0.67) | HCRTR1EDNRAEDNRBTSHRPGR | |
| SCHEMBL8394226 | 0.81 | EDNRA (0.70) | HCRTR1EDNRAEDNRBTSHRPGR | |
| SCHEMBL8055569 | 0.80 | EDNRA (0.76) | EDNRATSHR | |
| SCHEMBL8393188 | 0.80 | HCRTR1 (0.46) | HCRTR1EDNRAEDNRBTSHRPGR | |
| SCHEMBL8395646 | 0.80 | HCRTR1 (0.49) | HCRTR1EDNRAEDNRBTSHRPGR | |
| SCHEMBL7772536 | 0.79 | EDNRA (0.67) | HCRTR1EDNRAEDNRBTSHRPGR | |
| SCHEMBL8396364 | 0.77 | EDNRA (0.72) | HCRTR1EDNRAEDNRBTSHRPGR | |
| SCHEMBL8390571 | 0.76 | EDNRA (0.46) | HCRTR1EDNRAEDNRBTSHRPGR | |
| SCHEMBL12793182 | 0.75 | GAA (0.60) | EDNRATSHRPGRRORARORC |
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 |