Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | SLC6A1 | P30531 | 1/20 | 0.42 |
| ▸ | HRH2 | P25021 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 14/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 11/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL2140502 | 0.82 | CHRM2 (0.46) | HRH2HRH1 | |
| SCHEMBL12101084 | 0.79 | CYP3A4 (0.43) | GRM5CYP3A4CYP2D6ALDH1A1CYP1A2 | |
| SCHEMBL12100972 | 0.79 | CYP3A4 (0.46) | GRM5CYP3A4CYP2D6ALDH1A1HPGD | |
| SCHEMBL12100975 | 0.76 | CYP3A4 (0.40) | GRM5POLBCYP3A4CYP2D6ALDH1A1 | |
| SCHEMBL12100964 | 0.75 | CYP3A4 (0.46) | GRM5CYP3A4CYP2D6ALDH1A1HPGD | |
| SCHEMBL4379805 | 0.72 | SLC6A1 (0.38) | GRM5SLC6A1POLBCYP3A4CYP2D6 | |
| SCHEMBL12101048 | 0.72 | CYP3A4 (0.49) | GRM5CYP3A4CYP2D6ALDH1A1CYP1A2 | |
| SCHEMBL16132007 | 0.72 | ALDH1A1 (0.56) | HRH2HRH1POLBALDH1A1HPGD | |
| SCHEMBL4157157 | 0.69 | HPGD (0.66) | POLBALDH1A1HPGD | |
| SCHEMBL17319591 | 0.69 | HPGD (0.66) | POLBALDH1A1HPGDHTR1A |
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 |