Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.58 |
| ▸ | SLC1A3 | P43003 | 6/20 | 0.47 |
| ▸ | SLC1A2 | P43004 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 6/20 | 0.41 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 5/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.37 |
| ▸ | GRIK3 | Q13003 | 2/20 | 0.37 |
| ▸ | GRIK5 | Q16478 | 2/20 | 0.37 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.37 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.37 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.35 |
| ▸ | DNPEP | Q9ULA0 | 1/20 | 0.35 |
| ▸ | LARS1 | Q9P2J5 | 1/20 | 0.33 |
| ▸ | CIT | O14578 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Aspartic Acid SCHEMBL28155193 | 0.83 | ALDH1A1 (0.45) | SLC7A5SLC1A3SLC1A2ALDH1A1FKBP5 | |
| Imidazole SCHEMBL28128892 | 0.83 | ALDH1A1 (0.45) | SLC7A5SLC1A3SLC1A2ALDH1A1FKBP5 | |
| Alanine SCHEMBL8532370 | 0.83 | ALDH1A1 (0.52) | SLC7A5ALDH1A1FKBP5CYP3A4 | |
| Alanine SCHEMBL8532378 | 0.83 | ALDH1A1 (0.52) | SLC7A5ALDH1A1FKBP5CYP3A4 | |
| Serine SCHEMBL424445 | 0.81 | ALDH1A1 (0.46) | SLC7A5SLC1A3SLC1A2ALDH1A1FKBP5 | |
| Serine SCHEMBL424443 | 0.81 | ALDH1A1 (0.46) | SLC7A5SLC1A3SLC1A2ALDH1A1FKBP5 | |
| Norvaline SCHEMBL29109613 | 0.81 | SLC1A2 (0.42) | SLC7A5SLC1A3SLC1A2ALDH1A1FKBP5 | |
| Cysteine SCHEMBL28497338 | 0.80 | PTGS1 (0.55) | SLC7A5ALDH1A1FKBP5CYP3A4GRIK1 | |
| Leucine SCHEMBL28356659 | 0.79 | SLC7A5 (0.72) | SLC7A5SLC1A3SLC1A2SLC1A1GRIK1 | |
| Leucine SCHEMBL5874172 | 0.79 | SLC7A5 (0.72) | SLC7A5SLC1A3SLC1A2SLC1A1GRIK1 |
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-106966988-A | A kind of method of use microwave radiation synthesizing amino acid imidazole salts in aqueous | 上海应用技术大学 | 2017-07-21 | — | — | CN | disclosed |