Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | EDNRA | P25101 | 17/20 | 0.46 |
| ▸ | EDNRB | P24530 | 5/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL7837700 | 1.00 | ALDH1A1 (0.47) | ALDH1A1HTTEDNRAEDNRBABCB1 | |
| SCHEMBL7837861 | 0.90 | ALDH1A1 (0.46) | ALDH1A1HTTEDNRAEDNRBABCB1 | |
| SCHEMBL7837858 | 0.90 | ALDH1A1 (0.46) | ALDH1A1HTTEDNRAEDNRBABCB1 | |
| SCHEMBL7840779 | 0.87 | EDNRA (0.54) | ALDH1A1HTTEDNRAEDNRB | |
| SCHEMBL7840776 | 0.87 | EDNRA (0.54) | ALDH1A1HTTEDNRAEDNRB | |
| SCHEMBL7844692 | 0.85 | EDNRA (0.62) | ALDH1A1HTTEDNRAEDNRB | |
| SCHEMBL7844690 | 0.85 | EDNRA (0.62) | ALDH1A1HTTEDNRAEDNRB | |
| Nebentan SCHEMBL5272291 | 0.85 | EDNRA (0.59) | EDNRAEDNRB | |
| Nebentan SCHEMBL5272299 | 0.85 | EDNRA (0.59) | EDNRAEDNRB | |
| Nebentan SCHEMBL29372258 | 0.85 | EDNRA (0.59) | EDNRAEDNRB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0882719-B1 | ARYLETHENESULFONAMIDE DERIVATIVES AND DRUG COMPOSITION CONTAINING THE SAME | YAMANOUCHI PHARMA CO LTD (JP) | 2001-05-16 | — | — | EP | disclosed |
| US-6083955-A | HAVING A HIGH AFFINITY FOR DRUGS, ESPECIALLY ENDOSERINE RECEPTORS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 2000-07-04 | — | — | US | disclosed |
| EP-0882719-A1 | ARYLETHENESULFONAMIDE DERIVATIVES AND DRUG COMPOSITION CONTAINING THE SAME | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1998-12-09 | — | — | EP | disclosed |