Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14026070 | 1.00 | CYP2C9 (0.39) | CYP2C9CYP2C19TRPA1TRPM8CHRM3 | |
| SCHEMBL22375179 | 1.00 | CYP2C9 (0.39) | CYP2C9CYP2C19TRPA1TRPM8CHRM3 | |
| SCHEMBL8870586 | 1.00 | CYP2C9 (0.39) | CYP2C9CYP2C19TRPA1TRPM8CHRM3 | |
| SCHEMBL927772 | 1.00 | CYP2C9 (0.39) | CYP2C9CYP2C19TRPA1TRPM8CHRM3 | |
| SCHEMBL12159717 | 1.00 | CYP2C9 (0.39) | CYP2C9CYP2C19TRPA1TRPM8CHRM3 | |
| SCHEMBL15061116 | 1.00 | CYP2C9 (0.39) | CYP2C9CYP2C19TRPA1TRPM8CHRM3 | |
| SCHEMBL927770 | 1.00 | CYP2C9 (0.39) | CYP2C9CYP2C19TRPA1TRPM8CHRM3 | |
| Water SCHEMBL28276387 | 0.98 | CYP2C9 (0.38) | CYP2C9CYP2C19TRPA1TRPM8CHRM3 | |
| Water SCHEMBL28276386 | 0.98 | CYP2C9 (0.38) | CYP2C9CYP2C19TRPA1TRPM8CHRM3 | |
| SCHEMBL1097170 | 0.94 | CYP2C19 (0.41) | CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5962689-A | BIOSYNTHESIS OF ANTISEROTONIN AGENT | BRANTFORD CHEMICALS INC. (CA) | 1999-10-05 | — | — | US | disclosed |