Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | ACACB | O00763 | 1/20 | 0.45 |
| ▸ | SLC7A5 | Q01650 | 3/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17054157 | 0.87 | ALDH1A1 (0.46) | ALDH1A1SLC7A5 | |
| SCHEMBL14032566 | 0.86 | ALDH1A1 (0.45) | ALDH1A1SLC7A5 | |
| SCHEMBL5112269 | 0.86 | ALDH1A1 (0.45) | ALDH1A1SLC7A5 | |
| SCHEMBL22444755 | 0.86 | SLC7A5 (0.51) | ALDH1A1SLC7A5 | |
| SCHEMBL22444675 | 0.85 | ACACB (0.38) | ALDH1A1ACACBTUBB1CHRM4 | |
| Hydrochloric Acid SCHEMBL5112261 | 0.84 | ALDH1A1 (0.47) | ALDH1A1SLC7A5 | |
| Hydrochloric Acid SCHEMBL5112267 | 0.84 | ALDH1A1 (0.47) | ALDH1A1SLC7A5 | |
| SCHEMBL9162838 | 0.83 | ALDH1A1 (0.54) | ALDH1A1 | |
| SCHEMBL9162835 | 0.83 | ALDH1A1 (0.54) | ALDH1A1 | |
| SCHEMBL3967937 | 0.82 | ALDH1A1 (0.47) | ALDH1A1SLC7A5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113692401-A | Process for producing aromatic amino acid derivative | 中外制药株式会社 | 2021-11-23 | — | — | CN | disclosed |
| WO-2020189540-A1 | METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE | 中外製薬株式会社 | 2020-09-24 | — | — | WO | disclosed |