Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 14/20 | 0.51 |
| ▸ | CTSD | P07339 | 9/20 | 0.51 |
| ▸ | BACE2 | Q9Y5Z0 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5222976 | 0.86 | KLK5 (0.53) | BACE1CTSDBACE2 | |
| SCHEMBL5404137 | 0.86 | KLK5 (0.53) | BACE1CTSDBACE2 | |
| SCHEMBL5404127 | 0.86 | KLK5 (0.53) | BACE1CTSDBACE2 | |
| SCHEMBL3357333 | 0.85 | BACE1 (0.55) | BACE1CTSDBACE2ALDH1A1HTT | |
| SCHEMBL3357325 | 0.85 | BACE1 (0.55) | BACE1CTSDBACE2ALDH1A1HTT | |
| SCHEMBL6111643 | 0.84 | BACE1 (0.56) | BACE1CTSDBACE2 | |
| SCHEMBL5223062 | 0.80 | BACE1 (0.56) | BACE1CTSDBACE2ALDH1A1HTT | |
| SCHEMBL13307719 | 0.76 | BACE1 (0.60) | BACE1CTSD | |
| SCHEMBL13307722 | 0.76 | BACE1 (0.60) | BACE1CTSD | |
| SCHEMBL3347460 | 0.76 | MAOA (0.46) | BACE1CTSDBACE2ALDH1A1HTT |
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-1567488-A1 | HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE | GLAXO GROUP LIMITED (GB) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004050619-A1 | HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE | GLAXO GROUP LIMITED (GB) | 2004-06-17 | — | — | WO | disclosed |