Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 1/20 | 0.51 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.37 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.37 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.37 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.37 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.37 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.37 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5221970 | 0.98 | CTSD (0.49) | CTSDBACE1BACE2ALDH1A1CYP2C9 | |
| SCHEMBL5222278 | 0.89 | CTSD (0.48) | CTSDBACE1BACE2ALDH1A1CYP2C9 | |
| SCHEMBL5221500 | 0.85 | CTSD (0.46) | CTSDBACE1BACE2ALDH1A1CYP3A4 | |
| SCHEMBL5219361 | 0.85 | GAA (0.44) | CTSDBACE1BACE2ALDH1A1CYP2C9 | |
| SCHEMBL5220565 | 0.83 | CTSD (0.42) | CTSDBACE1BACE2ALDH1A1CYP2C9 | |
| SCHEMBL5221844 | 0.78 | HSD17B10 (0.43) | CTSDBACE1BACE2ALDH1A1CYP2C9 | |
| SCHEMBL5390345 | 0.78 | CTSD (0.42) | CTSDBACE1BACE2ALDH1A1CYP2C9 | |
| SCHEMBL5222116 | 0.77 | CASP1 (0.43) | CTSDBACE1BACE2ALDH1A1MEN1 | |
| SCHEMBL5226004 | 0.77 | CTSD (0.36) | CTSDBACE1BACE2 | |
| SCHEMBL5226007 | 0.77 | POLB (0.39) | CTSDBACE1BACE2GAAF10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1567488-B1 | HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE | GLAXO GROUP LTD (GB) | 2007-02-21 | — | — | EP | disclosed |