Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | PLAU | P00749 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | F12 | P00748 | 1/20 | 0.43 |
| ▸ | NCF1 | P14598 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.43 |
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | FDPS | P14324 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | PLG | P00747 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL291193 | 0.79 | CYP2A6 (0.50) | TRPA1LMNAPLAUCYP2A6F12 | |
| SCHEMBL28033606 | 0.76 | TRPA1 (0.47) | TRPA1LMNAPLAUCYP2A6F12 | |
| SCHEMBL13954037 | 0.76 | TRPA1 (0.53) | TRPA1LMNAPLAUCYP2A6F12 | |
| SCHEMBL31498832 | 0.75 | TRPA1 (0.60) | TRPA1LMNAPLAUCYP2A6F12 | |
| SCHEMBL6110247 | 0.75 | TRPA1 (0.60) | TRPA1LMNAPLAUCYP2A6F12 | |
| SCHEMBL28241638 | 0.73 | LMNA (0.54) | TRPA1LMNAPLAUCYP2A6F12 | |
| SCHEMBL10578906 | 0.72 | TRPA1 (0.43) | TRPA1LMNAPLAUCYP2A6F12 | |
| SCHEMBL2231183 | 0.72 | CYP2A6 (0.55) | TRPA1LMNAPLAUCYP2A6F12 | |
| SCHEMBL5015062 | 0.72 | PLAU (0.50) | TRPA1LMNAPLAUCYP2A6F12 | |
| SCHEMBL30223171 | 0.72 | CYP2A6 (0.55) | TRPA1LMNAPLAUCYP2A6F12 |
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-115286573-A | Green synthesis method of 1-alkoxy isoquinoline compound | 常州工程职业技术学院 | 2022-11-04 | — | — | CN | disclosed |