Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 18/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 16/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 6/20 | 0.39 |
| ▸ | USP2 | O75604 | 5/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2142831 | 0.85 | CHRM3 (0.51) | — | |
| SCHEMBL1245055 | 0.83 | CHRM2 (0.54) | CYP2D6CYP3A4ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL12101021 | 0.80 | CYP2D6 (0.44) | CYP2D6CYP3A4ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL12101058 | 0.78 | CHRM2 (0.53) | CYP2D6CYP3A4ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL12101016 | 0.78 | CYP2D6 (0.43) | CYP2D6CYP3A4ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL12101023 | 0.77 | CYP3A4 (0.42) | CYP2D6CYP3A4ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL12101029 | 0.72 | CYP3A4 (0.47) | CYP2D6CYP3A4ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL12100997 | 0.72 | CHRM2 (0.49) | CYP2D6CYP3A4ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL2141352 | 0.71 | CHRM2 (0.52) | — | |
| SCHEMBL12101094 | 0.71 | CYP3A4 (0.44) | CYP2D6CYP3A4ALDH1A1CYP1A2CYP2C19 |
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-2242759-B1 | COMPOUNDS | ASTRAZENECA AB (SE) | 2012-09-12 | — | — | EP | disclosed |