Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.35 |
| ▸ | PDE2A | O00408 | 2/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL22719282 | 0.99 | HTR2C (0.38) | HTR2CSLC6A2SLC6A4KIF11HSD11B1 | |
| SCHEMBL624834 | 0.87 | PDE2A (0.37) | SLC6A2SLC6A4KIF11HSD11B1PDE2A | |
| SCHEMBL22719169 | 0.84 | SLC6A2 (0.35) | SLC6A2SLC6A4HSD11B1CTSSCTSK | |
| SCHEMBL22728424 | 0.80 | PDE2A (0.46) | SLC6A2SLC6A4PDE2A | |
| Hydrochloric Acid SCHEMBL29453682 | 0.79 | PDE2A (0.45) | SLC6A2SLC6A4PDE2A | |
| Hydrochloric Acid SCHEMBL22719340 | 0.79 | PDE2A (0.45) | SLC6A2SLC6A4PDE2A | |
| SCHEMBL24485518 | 0.79 | HTR2C (0.40) | HTR2CSLC6A2SLC6A4HSD11B1PDE2A | |
| SCHEMBL22728401 | 0.75 | HTR2C (0.30) | HTR2C | |
| Hydrochloric Acid SCHEMBL22719327 | 0.74 | — | — | |
| SCHEMBL22719446 | 0.72 | MAPT (0.47) | TACR1MMP13 |
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 |