Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6827024 | 0.83 | MAPT (0.35) | MAPTNPSR1ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL25072267 | 0.74 | TDP1 (0.35) | — | |
| SCHEMBL31361283 | 0.71 | ALDH1A1 (0.31) | ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL31541755 | 0.67 | — | — | |
| SCHEMBL26977977 | 0.67 | CCNA2 (0.44) | NPSR1ALDH1A1CYP1A2 | |
| SCHEMBL5957149 | 0.65 | CYP1A2 (0.34) | ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL6937873 | 0.64 | CYP1A2 (0.36) | ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL30696307 | 0.64 | CYP1A2 (0.41) | ALDH1A1CYP1A2 | |
| SCHEMBL23657132 | 0.64 | CYP1A2 (0.41) | ALDH1A1CYP1A2 | |
| SCHEMBL21411447 | 0.62 | MAPT (0.41) | MAPTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004108707-A1 | PYRIDAZINIL QUINAZOLINE DERIVATIVES FOR USE IN THE TREATMENT OF TUMOURS | ASTRAZENECA AB (SE) | 2004-12-16 | — | — | WO | disclosed |