Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.53 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.48 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28271662 | 1.00 | MEN1 (0.55) | MEN1KMT2AALDH1A1ASAH1ACER2 | |
| SCHEMBL23617813 | 0.90 | SMN1; SMN2 (0.48) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL9876469 | 0.90 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL13314953 | 0.90 | ATM (0.49) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL9876522 | 0.88 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL28270210 | 0.87 | ERAP2 (0.55) | MEN1KMT2AALDH1A1ASAH1ACER2 | |
| SCHEMBL28270209 | 0.87 | ERAP2 (0.55) | MEN1KMT2AALDH1A1ASAH1ACER2 | |
| SCHEMBL28252260 | 0.86 | ALDH1A1 (0.53) | MEN1KMT2AALDH1A1ASAH1ACER2 | |
| SCHEMBL28252259 | 0.86 | ALDH1A1 (0.53) | MEN1KMT2AALDH1A1ASAH1ACER2 | |
| SCHEMBL30605518 | 0.85 | EPHX2 (0.46) | ALDH1A1EPHX2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109081789-A | The positive positive hexanoyl fatty acid/amino acid of hexanoyl amino first cyclic amide base of amino, synthesis, activity and application | 首都医科大学 | 2018-12-25 | — | — | CN | disclosed |