Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | XBP1 | P17861 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | EDNRB | P24530 | 2/20 | 0.36 |
| ▸ | EDNRA | P25101 | 2/20 | 0.36 |
| ▸ | FBP1 | P09467 | 1/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7065435 | 0.87 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1HTTNPC1HSP90AA1 | |
| SCHEMBL7828012 | 0.84 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1HTTNPC1HSP90AA1 | |
| SCHEMBL7831845 | 0.84 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1HTTNPC1HSP90AA1 | |
| SCHEMBL7817828 | 0.82 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1HTTNPC1HSP90AA1 | |
| SCHEMBL7828200 | 0.82 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1HTTNPC1HSP90AA1 | |
| SCHEMBL7826460 | 0.82 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1HTTNPC1HSP90AA1 | |
| SCHEMBL7826524 | 0.82 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1HTTNPC1HSP90AA1 | |
| SCHEMBL7831802 | 0.81 | EDNRA (0.39) | ALDH1A1L3MBTL1HTTNPC1HSP90AA1 | |
| SCHEMBL7823695 | 0.80 | EDNRB (0.43) | ALDH1A1L3MBTL1HTTSCN9AMAPK1 | |
| SCHEMBL7824858 | 0.80 | HCRTR2 (0.39) | ALDH1A1L3MBTL1HTTNPC1HSP90AA1 |
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-0811001-B1 | BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS | WARNER LAMBERT CO (US) | 2001-10-31 | — | — | EP | claimed |