Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6711069 | 0.82 | OPRM1 (0.50) | CYP2D6CYP1A2CYP2C19OPRM1SIGMAR1 | |
| SCHEMBL5830799 | 0.80 | SIGMAR1 (0.46) | CYP2D6CYP1A2CYP2C19SIGMAR1CTNNB1 | |
| SCHEMBL8326605 | 0.77 | CYP2D6 (0.50) | CYP2D6CYP1A2CYP2C19OPRM1SIGMAR1 | |
| SCHEMBL8686986 | 0.73 | CYP1A2 (0.44) | CYP2D6CYP1A2CYP2C19SIGMAR1CTNNB1 | |
| SCHEMBL7528890 | 0.71 | CYP1A2 (0.53) | CYP2D6CYP1A2CYP2C19SIGMAR1CTNNB1 | |
| SCHEMBL6445467 | 0.71 | HTR1B (0.47) | CYP2D6CYP1A2CYP2C19SIGMAR1MMP9 | |
| SCHEMBL7297662 | 0.70 | CTNNB1 (0.46) | CYP2D6CYP1A2CYP2C19OPRM1MMP9 | |
| SCHEMBL108121 | 0.70 | CYP1A2 (0.50) | CYP2D6CYP1A2CYP2C19SIGMAR1CYP2C9 | |
| SCHEMBL4817490 | 0.69 | CYP1A2 (0.47) | CYP2D6CYP1A2CYP2C19SIGMAR1CTNNB1 | |
| SCHEMBL6448844 | 0.69 | CYP2D6 (0.51) | CYP2D6CYP1A2CYP2C19OPRM1SIGMAR1 |
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-1392315-A1 | METHODS OF TREATING ALZHEIMER'S DISEASE | Elan Pharmaceuticals, Inc. (US) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002100410-A1 | METHODS OF TREATING ALZHEIMER'S DISEASE | ELAN PHARMACEUTICALS, INC. (US) | 2002-12-19 | — | — | WO | disclosed |