Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 14/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 12/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 3/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 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 | |
|---|---|---|---|---|
| SCHEMBL12101023 | 0.91 | CYP3A4 (0.42) | CYP3A4CYP2D6CHRM2CHRM3CYP2C19 | |
| SCHEMBL2142425 | 0.87 | CHRM2 (0.56) | CHRM2CHRM3HRH3 | |
| SCHEMBL2140608 | 0.77 | CHRM2 (0.57) | CHRM2CHRM3HRH3 | |
| SCHEMBL12101058 | 0.77 | CHRM2 (0.53) | CYP3A4CYP2D6CHRM2CHRM3CYP2C19 | |
| SCHEMBL1245055 | 0.77 | CHRM2 (0.54) | CYP3A4CYP2D6CHRM2CHRM3CYP2C19 | |
| SCHEMBL2142602 | 0.73 | CHRM2 (0.52) | CHRM2CHRM3 | |
| SCHEMBL12095659 | 0.73 | CHRM2 (0.58) | CYP3A4CYP2D6CHRM2CHRM3CYP2C19 | |
| SCHEMBL12100997 | 0.69 | CHRM2 (0.49) | CYP3A4CYP2D6CHRM2CHRM3CYP2C19 | |
| SCHEMBL12101098 | 0.69 | CHRM2 (0.50) | CYP3A4CYP2D6CHRM2CHRM3CYP2C19 | |
| SCHEMBL12101030 | 0.68 | CYP2D6 (0.43) | CYP3A4CYP2D6CYP2C19CYP2C9CYP1A2 |
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 |