Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | NAMPT | P43490 | 3/20 | 0.39 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.38 |
| ▸ | RHOA | P61586 | 1/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.35 |
| ▸ | NEK2 | P51955 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23884427 | 1.00 | SCN9A (0.39) | SCN9ANAMPTGRIA1RHOADGAT1 | |
| SCHEMBL30251682 | 0.95 | NOTUM (0.40) | SCN9ANAMPTGRIA1DGAT1ADORA2A | |
| SCHEMBL30251699 | 0.95 | NOTUM (0.40) | SCN9ANAMPTGRIA1DGAT1ADORA2A | |
| SCHEMBL23906194 | 0.95 | NOTUM (0.40) | SCN9ANAMPTGRIA1DGAT1ADORA2A | |
| SCHEMBL23884724 | 0.95 | NOTUM (0.40) | SCN9ANAMPTGRIA1DGAT1ADORA2A | |
| SCHEMBL23884643 | 0.95 | NOTUM (0.40) | SCN9ANAMPTGRIA1DGAT1ADORA2A | |
| SCHEMBL30251635 | 0.91 | NAMPT (0.36) | NAMPTGRIA1S1PR1NOTUMROCK2 | |
| SCHEMBL23884659 | 0.91 | NAMPT (0.36) | NAMPTGRIA1S1PR1NOTUMROCK2 | |
| SCHEMBL23906346 | 0.86 | NAMPT (0.43) | NAMPTGRIA1CYP1A2CYP2C9ROCK2 | |
| SCHEMBL28957886 | 0.86 | GRIA1 (0.33) | NAMPTGRIA1CLK4ROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115715292-A | 1H-pyrazolo [4,3-g ] isoquinoline and 1H-pyrazolo [4,3-g ] quinoline derivatives as alpha-1-antitrypsin modulators for the treatment of alpha-1-antitrypsin deficiency (AATD) | 弗特克斯药品有限公司 | 2023-02-24 | — | — | CN | disclosed |