Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9761831 | 0.74 | CCR6 (0.33) | ALDH1A1MAPT | |
| SCHEMBL9762512 | 0.64 | ALDH1A1 (0.41) | ALDH1A1HPGDALOX15MAPT | |
| Water SCHEMBL28227714 | 0.59 | ALDH1A1 (0.32) | ALDH1A1HPGDALOX15 | |
| SCHEMBL28276642 | 0.59 | MGMT (0.38) | ALDH1A1HPGDMAPT | |
| SCHEMBL29232798 | 0.57 | ALDH1A1 (0.40) | ALDH1A1HPGDALOX15MAPT | |
| SCHEMBL438677 | 0.57 | ALDH1A1 (0.40) | ALDH1A1ALOX15MAPT | |
| SCHEMBL7701711 | 0.57 | ALDH1A1 (0.35) | ALDH1A1HPGDALOX15MAPT | |
| SCHEMBL20553556 | 0.57 | ALDH1A1 (0.35) | ALDH1A1HPGDALOX15MAPT | |
| SCHEMBL25063183 | 0.57 | MAPT (0.39) | ALDH1A1HPGDALOX15MAPT | |
| Barium SCHEMBL31718046 | 0.55 | ALDH1A1 (0.39) | ALDH1A1HPGDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5026694-A | Antitumor agents | THE BRITISH COLUMBIA CANCER FOUNDATION (CA) | 1991-06-25 | — | — | US | disclosed |