Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 2/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL7760399 | 1.00 | CHRM2 (0.32) | CHRM2CHRM5CHRM1TSHRMAPK1 | |
| SCHEMBL7763924 | 0.81 | CNR1 (0.33) | CNR1CNR2 | |
| SCHEMBL7763932 | 0.81 | CNR1 (0.33) | CNR1CNR2 | |
| SCHEMBL16297461 | 0.80 | — | — | |
| SCHEMBL22454917 | 0.80 | — | — | |
| SCHEMBL7764367 | 0.77 | EPHX1 (0.34) | CNR1CNR2 | |
| SCHEMBL7764363 | 0.77 | EPHX1 (0.34) | CNR1CNR2 | |
| SCHEMBL7764100 | 0.74 | EPHX1 (0.46) | — | |
| SCHEMBL7764093 | 0.74 | EPHX1 (0.46) | — | |
| SCHEMBL7765220 | 0.72 | CNR1 (0.31) | CNR1CNR2 |
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-0927176-B1 | 1,3-DIOXANE DERIVATIVES, SYNTHESIS METHOD THEREFOR AND AROMATIC COMPOSITIONS CONTAINING SAME | PERNOD RICARD (FR) | 2001-05-30 | — | — | EP | disclosed |