Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.40 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.38 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.38 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | USP19 | O94966 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5217794 | 0.87 | MAPT (0.40) | ALDH1A1CYP2C9CYP3A4CTSDBACE1 | |
| SCHEMBL5223584 | 0.82 | CTSD (0.51) | ALDH1A1CYP2C9HPGDCYP3A4CYP1A2 | |
| SCHEMBL5220565 | 0.78 | CTSD (0.42) | ALDH1A1CYP2C9HPGDCYP3A4CYP1A2 | |
| SCHEMBL23809452 | 0.74 | SLC22A12 (0.41) | CYP1A2HSD17B10MEN1KMT2AACE2 | |
| SCHEMBL5220175 | 0.72 | CTSD (0.48) | ALDH1A1CYP2C9CYP3A4CTSDBACE1 | |
| SCHEMBL5219489 | 0.71 | ALDH1A1 (0.47) | ALDH1A1CYP2C9HPGDCYP3A4CYP1A2 | |
| SCHEMBL23809368 | 0.70 | ACE2 (0.37) | ACE2 | |
| SCHEMBL5217707 | 0.70 | ALDH1A1 (0.54) | ALDH1A1CYP2C9HPGDCYP3A4CYP1A2 | |
| SCHEMBL5222262 | 0.69 | ALDH1A1 (0.50) | ALDH1A1CYP2C9HPGDCYP3A4CYP1A2 | |
| SCHEMBL25352612 | 0.68 | ALDH1A1 (0.49) | ALDH1A1CYP2C9HPGDCYP3A4CYP1A2 |
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 |