Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A1 | P30531 | 2/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7364398 | 0.91 | SLC6A1 (0.43) | SLC6A1PTGS1PDE4AALDH1A1 | |
| SCHEMBL7361316 | 0.76 | SLC6A1 (0.38) | SLC6A1ALDH1A1 | |
| SCHEMBL5278208 | 0.72 | SLC6A1 (0.49) | SLC6A1PTGS1PDE4AALDH1A1 | |
| SCHEMBL5278197 | 0.72 | SLC6A1 (0.49) | SLC6A1PTGS1PDE4AALDH1A1 | |
| SCHEMBL29061755 | 0.71 | SLC6A1 (0.61) | SLC6A1PTGS1PDE4AALDH1A1 | |
| SCHEMBL5278203 | 0.71 | SLC6A1 (0.55) | SLC6A1PTGS1PDE4A | |
| Hydrochloric Acid SCHEMBL29061748 | 0.70 | SLC6A1 (0.61) | SLC6A1PTGS1PDE4AALDH1A1 | |
| SCHEMBL7239606 | 0.64 | ATM (0.43) | SLC6A1PTGS1PDE4AALDH1A1 | |
| SCHEMBL3563641 | 0.64 | ALDH1A1 (0.49) | ALDH1A1 | |
| SCHEMBL12259378 | 0.64 | ALDH1A1 (0.49) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0236342-A1 | AMINO ACID DERIVATIVES. | NOVO INDUSTRI AS (DK) | 1987-09-16 | — | — | EP | disclosed |
| WO-1987000171-A1 | AMINO ACID DERIVATIVES | NOVO INDUSTRI A/S (DK) | 1987-01-15 | — | — | WO | disclosed |