Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 5/20 | 0.43 |
| ▸ | HTR1B | P28222 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4712681 | 0.89 | GRM5 (0.42) | CYP1A2CYP2D6CYP2C19GRM5HTR1B | |
| SCHEMBL4710981 | 0.89 | GRM5 (0.47) | CYP1A2CYP2D6CYP2C19GRM5HTR1B | |
| SCHEMBL4711565 | 0.88 | HTR1B (0.45) | CYP1A2CYP2D6CYP2C19GRM5HTR1B | |
| SCHEMBL4712038 | 0.86 | GRM5 (0.49) | GRM5 | |
| SCHEMBL4710338 | 0.82 | CYP1A2 (0.41) | CYP1A2CYP2D6CYP2C19HTR1B | |
| SCHEMBL4710655 | 0.80 | GRM5 (0.52) | GRM5 | |
| SCHEMBL4713849 | 0.74 | GRM5 (0.57) | GRM5ABL1 | |
| SCHEMBL4713011 | 0.74 | GRM5 (0.49) | GRM5ABL1 | |
| SCHEMBL7349972 | 0.74 | ALDH1A1 (0.46) | CYP1A2CYP2D6CYP2C19FFAR1 | |
| SCHEMBL4711495 | 0.73 | GRM5 (0.46) | GRM5FFAR1 |
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-0998459-B1 | PYRIDINE DERIVATIVES | NOVARTIS AG (CH) | 2008-04-23 | — | — | EP | claimed |