Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | SCN4A | P35499 | 1/20 | 0.34 |
| ▸ | SCN7A | Q01118 | 1/20 | 0.34 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29786158 | 0.84 | TRPA1 (0.39) | TRPA1GRIN1GRIN2AGRIN2BOPRM1 | |
| SCHEMBL29786162 | 0.84 | TRPA1 (0.36) | TRPA1GRIN1GRIN2AGRIN2BOPRM1 | |
| SCHEMBL29786159 | 0.78 | TRPA1 (0.38) | TRPA1OPRM1OPRL1ALDH1A1SCN1A | |
| SCHEMBL29786156 | 0.78 | TRPA1 (0.38) | TRPA1CNR2DDB1CRBN | |
| SCHEMBL29786181 | 0.77 | TRPA1 (0.37) | TRPA1OPRM1OPRD1OPRK1CNR2 | |
| SCHEMBL29786174 | 0.70 | CXCR3 (0.35) | TRPA1OPRM1OPRD1OPRK1CNR2 | |
| SCHEMBL29786171 | 0.70 | SMN1; SMN2 (0.40) | TRPA1KDM4EOPRM1ALDH1A1OPRD1 | |
| SCHEMBL30017849 | 0.69 | TRPA1 (0.53) | TRPA1ALDH1A1DDB1CRBN | |
| SCHEMBL31414997 | 0.66 | TRPA1 (0.54) | TRPA1GRIN2BOPRL1ALDH1A1KCNH2 | |
| SCHEMBL26840521 | 0.66 | TRPA1 (0.54) | TRPA1GRIN2BOPRL1ALDH1A1KCNH2 |
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-113248422-B | Chiral alpha-aza-arene quaternary carbon center compound, and preparation method and application thereof | 河南工业大学 | 2022-07-12 | — | — | CN | disclosed |