Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 18/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11734584 | 0.85 | CYP1A2 (0.43) | CYP1A2CYP2C9PIM1MKNK1 | |
| SCHEMBL7998348 | 0.82 | CYP1A2 (0.45) | CYP1A2CYP2C9 | |
| SCHEMBL22834815 | 0.79 | CYP1A2 (0.47) | CYP1A2CYP2C9 | |
| SCHEMBL8089233 | 0.77 | CYP1A2 (0.36) | CYP1A2CYP2C9MKNK1 | |
| SCHEMBL1202690 | 0.75 | HTT (0.41) | CYP1A2CYP2C9 | |
| SCHEMBL7994114 | 0.74 | MKNK1 (0.40) | PIM1MKNK1 | |
| SCHEMBL9058561 | 0.74 | MKNK1 (0.38) | CYP1A2CYP2C9PIM1MKNK1 | |
| SCHEMBL8089274 | 0.72 | MKNK1 (0.34) | CYP1A2CYP2C9MKNK1 | |
| SCHEMBL2902233 | 0.71 | CYP1A2 (0.46) | CYP1A2CYP2C9 | |
| SCHEMBL430605 | 0.71 | TNF (0.50) | CYP1A2CYP2C9MKNK1 |
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-2001034578-A1 | COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY | ASTRAZENECA AB (SE) | 2001-05-17 | — | — | WO | disclosed |