Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 5/20 | 0.42 |
| ▸ | EDNRB | P24530 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | KLK7 | P49862 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8556595 | 0.77 | EDNRA (0.49) | EDNRAEDNRBALDH1A1KDM4EHPGD | |
| SCHEMBL27535427 | 0.74 | EDNRA (0.66) | EDNRAEDNRBALDH1A1KDM4ELMNA | |
| SCHEMBL8629235 | 0.73 | EDNRA (0.49) | EDNRAEDNRBALDH1A1KDM4EPOLB | |
| SCHEMBL28301304 | 0.69 | MAPT (0.37) | EDNRAALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL28151437 | 0.68 | LMNA (0.41) | EDNRALMNAPOLBMEN1TP53 | |
| SCHEMBL14165763 | 0.67 | LMNA (0.35) | EDNRAKDM4ELMNAHPGDHSD17B10 | |
| SCHEMBL27496629 | 0.66 | EDNRB (0.60) | EDNRAEDNRBALDH1A1KDM4ELMNA | |
| SCHEMBL9571061 | 0.65 | LMNA (0.34) | LMNAMEN1KMT2ATSHR | |
| SCHEMBL7341143 | 0.65 | KDM4E (0.48) | ALDH1A1KDM4ELMNAKLK7POLB | |
| SCHEMBL8629983 | 0.65 | EDNRA (0.48) | EDNRAEDNRBALDH1A1KDM4EHPGD |
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-0885219-A1 | N-(2,1,3-BENZOTHIA(OXA)DIAZOLYL)-SULPHONAMIDES HAVING AN ENDOTHELIN RECEPTOR ANTAGONISTIC EFFECT | MERCK PATENT GmbH (DE) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997030996-A1 | N-(2,1,3-BENZOTHIA(OXA)DIAZOLYL)-SULPHONAMIDES HAVING AN ENDOTHELIN RECEPTOR ANTAGONISTIC EFFECT | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1997-08-28 | — | — | WO | disclosed |