Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | EDNRA | P25101 | 6/20 | 0.41 |
| ▸ | EDNRB | P24530 | 2/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
| ▸ | DHPS | P49366 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | XPO1 | O14980 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7837861 | 1.00 | ALDH1A1 (0.46) | ALDH1A1HTTEDNRAEDNRBABCB1 | |
| SCHEMBL7837700 | 0.90 | ALDH1A1 (0.47) | ALDH1A1HTTEDNRAEDNRBABCB1 | |
| SCHEMBL7837698 | 0.90 | ALDH1A1 (0.47) | ALDH1A1HTTEDNRAEDNRBABCB1 | |
| SCHEMBL7844686 | 0.87 | DHPS (0.54) | ALDH1A1HTTEDNRAEDNRBDHPS | |
| SCHEMBL7844683 | 0.87 | DHPS (0.54) | ALDH1A1HTTEDNRAEDNRBDHPS | |
| SCHEMBL7839633 | 0.85 | EDNRA (0.50) | ALDH1A1HTTEDNRAEDNRBDHPS | |
| SCHEMBL7839629 | 0.85 | EDNRA (0.50) | ALDH1A1HTTEDNRAEDNRBDHPS | |
| SCHEMBL5271698 | 0.85 | EDNRA (0.52) | ALDH1A1HTTEDNRAEDNRB | |
| SCHEMBL5271700 | 0.85 | EDNRA (0.52) | ALDH1A1HTTEDNRAEDNRB | |
| SCHEMBL7840781 | 0.85 | ALDH1A1 (0.45) | ALDH1A1HTTEDNRAEDNRBDHPS |
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 |