Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 5/20 | 0.36 |
| ▸ | CNR1 | P21554 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11498434 | 0.83 | TSHR (0.47) | ALDH1A1MAPTMAPK1KDM4ETDP1 | |
| SCHEMBL11334627 | 0.79 | AOC3 (0.46) | ALDH1A1MAPTMAPK1GAAKDM4E | |
| SCHEMBL13181094 | 0.77 | ALDH1A1 (0.50) | ALDH1A1MAPTMAPK1GAAKDM4E | |
| SCHEMBL6984098 | 0.75 | ALDH1A1 (0.66) | ALDH1A1MAPTMAPK1GAAKDM4E | |
| SCHEMBL8538633 | 0.75 | ALDH1A1 (0.67) | ALDH1A1MAPTMAPK1GAAKDM4E | |
| SCHEMBL11275361 | 0.74 | KDM4E (0.60) | ALDH1A1MAPTMAPK1GAAKDM4E | |
| SCHEMBL23373570 | 0.74 | ALDH1A1 (0.47) | ALDH1A1MAPTMAPK1GAAKDM4E | |
| SCHEMBL14388128 | 0.73 | KCNH2 (0.47) | KDM4EAOC3LMNAL3MBTL1 | |
| SCHEMBL11746154 | 0.72 | TSHR (0.50) | ALDH1A1KDM4ETSHRLMNACYP3A4 | |
| SCHEMBL11467879 | 0.71 | CYP2D6 (0.40) | MAPTTHRBHTTAOC3LMNA |
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-0006458-A1 | N1-Benzoyl-N2-phenyl-1,3-diaminopropane-2-ols and their salts, process for their preparation and medicaments containing them | Kali-Chemie Pharma GmbH (DE) | 1980-01-09 | — | — | EP | disclosed |