Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL6318730 | 1.00 | ALDH1A1 (0.46) | ALDH1A1GAAPOLBNPSR1LMNA | |
| SCHEMBL9130782 | 0.83 | ALDH1A1 (0.38) | ALDH1A1GAAPOLBNPSR1LMNA | |
| SCHEMBL8675655 | 0.77 | MAOB (0.53) | GAALMNACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL11497391 | 0.73 | ALDH1A1 (0.50) | ALDH1A1GAALMNAPBRM1CYP1A2 | |
| SCHEMBL29061988 | 0.73 | ALDH1A1 (0.50) | ALDH1A1GAALMNAPBRM1CYP1A2 | |
| SCHEMBL6383878 | 0.72 | ALDH1A1 (0.53) | ALDH1A1GAALMNAPBRM1CYP1A2 | |
| SCHEMBL5054937 | 0.71 | ALDH1A1 (0.60) | ALDH1A1GAANPSR1LMNAPBRM1 | |
| SCHEMBL5176160 | 0.71 | ALDH1A1 (0.56) | ALDH1A1GAANPSR1LMNAPBRM1 | |
| Hydrochloric Acid SCHEMBL5685735 | 0.71 | ALDH1A1 (0.56) | ALDH1A1GAALMNAPBRM1CYP1A2 | |
| SCHEMBL28084017 | 0.70 | ALDH1A1 (0.47) | ALDH1A1GAAPOLBNPSR1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |
| CN-1681763-A | Chemical compounds | ASTRAZENECA AB (SE) | 2005-10-12 | — | — | CN | disclosed |