Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLNR | O43193 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP46A1 | Q9Y6A2 | 3/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.54 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.54 |
| ▸ | HTR2B | P41595 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | SCD | O00767 | 1/20 | 0.44 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29453745 | 1.00 | MLNR (0.57) | MLNRCYP3A4CYP46A1CYP2C9CYP2C19 | |
| SCHEMBL14849031 | 0.81 | CYP46A1 (0.85) | CYP3A4CYP46A1CYP2C9CYP2C19 | |
| SCHEMBL22719343 | 0.79 | CYP46A1 (0.56) | MLNRCYP3A4CYP46A1CYP2C9CYP2C19 | |
| SCHEMBL29453806 | 0.79 | CYP46A1 (0.56) | MLNRCYP3A4CYP46A1CYP2C9CYP2C19 | |
| SCHEMBL22719283 | 0.78 | CYP46A1 (0.65) | MLNRCYP3A4CYP46A1CYP2C9CYP2C19 | |
| SCHEMBL22719301 | 0.77 | CYP46A1 (0.56) | MLNRCYP3A4CYP46A1CYP2C9CYP2C19 | |
| SCHEMBL29453734 | 0.77 | CYP46A1 (0.54) | MLNRCYP3A4CYP46A1CYP2C9CYP2C19 | |
| SCHEMBL22719247 | 0.77 | CYP46A1 (0.54) | MLNRCYP3A4CYP46A1CYP2C9CYP2C19 | |
| SCHEMBL17455971 | 0.76 | CYP46A1 (0.64) | CYP46A1KMT2ACHRM2ALDH1A1LMNA | |
| SCHEMBL7232901 | 0.74 | CYP2C9 (0.70) | MLNRCYP3A4CYP46A1CYP2C9CYP2C19 |
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 |