Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP46A1 | Q9Y6A2 | 4/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.47 |
| ▸ | CCR3 | P51677 | 1/20 | 0.45 |
| ▸ | MGLL | Q99685 | 4/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | MLNR | O43193 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29453734 | 1.00 | CYP46A1 (0.54) | CYP46A1CYP2C9CYP2C19MAPK14CCR3 | |
| SCHEMBL22719343 | 0.90 | CYP46A1 (0.56) | CYP46A1CYP2C9CYP2C19MAPK14CCR3 | |
| SCHEMBL29453806 | 0.90 | CYP46A1 (0.56) | CYP46A1CYP2C9CYP2C19MAPK14CCR3 | |
| SCHEMBL22719301 | 0.86 | CYP46A1 (0.56) | CYP46A1CYP2C9CYP2C19MAPK14CCR3 | |
| SCHEMBL22719425 | 0.83 | CYP46A1 (0.52) | CYP46A1CYP2C9CYP2C19MAPK14CCR3 | |
| SCHEMBL29453783 | 0.83 | CYP46A1 (0.52) | CYP46A1CYP2C9CYP2C19MAPK14CCR3 | |
| SCHEMBL14849085 | 0.83 | CYP46A1 (0.76) | CYP46A1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL22719424 | 0.80 | CYP46A1 (0.59) | CYP46A1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL29453742 | 0.80 | CYP46A1 (0.59) | CYP46A1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL22719130 | 0.77 | MLNR (0.57) | CYP46A1CYP2C9CYP2C19MAPK14HTR2B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020243027-A1 | COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | SAGE THERAPEUTICS, INC. (US) | 2020-12-03 | — | — | WO | disclosed |