Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 5/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.55 |
| ▸ | TP53 | P04637 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | GAA | P10253 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | EDNRA | P25101 | 6/20 | 0.53 |
| ▸ | DHODH | Q02127 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8798258 | 0.84 | EDNRA (0.52) | ALDH1A1HSD17B10MEN1KMT2AMAPK1 | |
| SCHEMBL8800810 | 0.84 | TP53 (0.52) | ALDH1A1HSD17B10MEN1KMT2AMAPK1 | |
| SCHEMBL8576064 | 0.83 | ALDH1A1 (0.62) | ALDH1A1HSD17B10MEN1KMT2AMAPK1 | |
| SCHEMBL8798318 | 0.79 | MAPT (0.48) | ALDH1A1MEN1KMT2ATP53KDM4E | |
| SCHEMBL8798932 | 0.76 | PDE10A (0.50) | ALDH1A1HSD17B10MEN1KMT2AMAPK1 | |
| SCHEMBL8575921 | 0.72 | MEN1 (0.58) | ALDH1A1HSD17B10MEN1KMT2AMAPK1 | |
| SCHEMBL8577086 | 0.72 | TP53 (0.58) | ALDH1A1HSD17B10MEN1KMT2AMAPK1 | |
| SCHEMBL8798547 | 0.71 | EDNRB (0.56) | ALDH1A1HSD17B10MEN1KMT2AMAPK1 | |
| SCHEMBL8575587 | 0.67 | MEN1 (0.51) | ALDH1A1HSD17B10MEN1KMT2AMAPK1 | |
| SCHEMBL26143793 | 0.67 | KDM4E (0.54) | ALDH1A1HSD17B10MEN1KMT2ATP53 |
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-0757039-A1 | Endothelin receptor antagonists | MERCK PATENT GmbH (DE) | 1997-02-05 | — | — | EP | disclosed |