Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.58 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.58 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.58 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.58 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.58 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.40 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 2/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Epipolygodial SCHEMBL29370854 | 0.74 | CHRNB2 (1.00) | TRPA1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| Epipolygodial SCHEMBL21322435 | 0.74 | CHRNB2 (1.00) | TRPA1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| Polygodial SCHEMBL21633831 | 0.74 | CHRNB2 (1.00) | TRPA1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| Epipolygodial SCHEMBL13855685 | 0.74 | CHRNB2 (1.00) | TRPA1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| Polygodial SCHEMBL258239 | 0.74 | CHRNB2 (1.00) | TRPA1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| Mooloolabene B SCHEMBL31211718 | 0.66 | CHRNB2 (0.71) | TRPA1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| Mooloolabene A SCHEMBL31132209 | 0.66 | CHRNB2 (0.71) | TRPA1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL18480671 | 0.66 | CYP19A1 (0.31) | — | |
| SCHEMBL31132229 | 0.63 | PLA2G2A (0.73) | TRPA1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL31132118 | 0.63 | CHRNB2 (0.62) | TRPA1CHRNB2CHRNB4CHRNA3CHRNA4 |
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-3013330-B1 | ANTI-VIRAL COMPOUND AND COMPOSITION | FOREST HERBS RES LIMITED (NZ) | 2019-09-04 | — | — | EP | disclosed |