Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 19/20 | 0.56 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | TSPO | P30536 | 1/20 | 0.41 |
| ▸ | GPR183 | P32249 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15933902 | 0.90 | GPBAR1 (0.65) | GPBAR1CHRM5SLC6A2TSPOGPR183 | |
| SCHEMBL15933766 | 0.86 | GPBAR1 (0.41) | GPBAR1 | |
| SCHEMBL15933767 | 0.86 | GPBAR1 (0.56) | GPBAR1 | |
| SCHEMBL15933780 | 0.81 | GPBAR1 (0.73) | GPBAR1 | |
| SCHEMBL15933785 | 0.76 | GPBAR1 (0.63) | GPBAR1CHRM5SLC6A2TSPOGPR183 | |
| SCHEMBL15933773 | 0.75 | GPBAR1 (0.66) | GPBAR1 | |
| SCHEMBL28949532 | 0.74 | CYP3A4 (0.35) | GPBAR1 | |
| SCHEMBL15933784 | 0.72 | GPBAR1 (0.41) | GPBAR1 | |
| SCHEMBL15933822 | 0.72 | GPBAR1 (0.69) | GPBAR1 | |
| SCHEMBL30148107 | 0.72 | GPBAR1 (1.00) | GPBAR1 |
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-2014117292-A1 | AMIDE COMPOUNDS AND PREPARATION METHODS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | 中国科学院上海药物研究所 (CN) | 2014-08-07 | — | — | WO | disclosed |