Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 6/20 | 0.49 |
| ▸ | SCN5A | Q14524 | 4/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | DHPS | P49366 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL841717 | 0.99 | SCN9A (0.50) | SCN9ASCN5AKCNH2CYP19A1CYP11B1 | |
| SCHEMBL841245 | 0.85 | SCN9A (0.43) | SCN9ASCN5AKCNH2ADRA1AMAOA | |
| Ammonia Solution, Strong SCHEMBL3676946 | 0.85 | SCN9A (0.46) | SCN9ASCN5AKCNH2CYP19A1ADRA2A | |
| SCHEMBL839937 | 0.83 | SCN9A (0.47) | SCN9ASCN5AKCNH2CYP19A1ADRA2A | |
| SCHEMBL839693 | 0.83 | SCN9A (0.38) | SCN9ASCN5AKCNH2CYP19A1 | |
| SCHEMBL8823813 | 0.82 | ADRA2A (0.39) | SCN9ASCN5AKCNH2CYP19A1ADRA2A | |
| SCHEMBL8823817 | 0.82 | ADRA2A (0.39) | SCN9ASCN5AKCNH2CYP19A1ADRA2A | |
| Ammonia Solution, Strong SCHEMBL3674959 | 0.80 | SCN9A (0.35) | SCN9ASCN5AKCNH2CYP19A1CYP11B1 | |
| Ammonia Solution, Strong SCHEMBL3672811 | 0.79 | SCN9A (0.46) | SCN9ASCN5AKCNH2 | |
| SCHEMBL841223 | 0.78 | SCN5A (0.38) | SCN9ASCN5AKCNH2CYP3A4CYP2A6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2158198-A2 | NOVEL N- (8HETEROARYLTETRAHYDRONAPHTALENE-2YL) OR N- (5- HETEROARYLCHROMANE-3-YL) CARBOXAMIDE DERIVATIVES FOR THE TREATMENT OF PAIN | AstraZeneca AB (SE) | 2010-03-03 | — | — | EP | disclosed |
| WO-2008130320-A2 | NOVEL N- (8-HETEROARYLTETRAHYDRONAPHTALENE-2YL) OR N- (5- HETEROARYLCHROMANE-3-YL) CARBOXAMIDE DERIVATIVES FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2008-10-30 | — | — | WO | disclosed |