Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | NR1H2 | P55055 | 13/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 8/20 | 0.39 |
| ▸ | PPARG | P37231 | 3/20 | 0.39 |
| ▸ | PPARD | Q03181 | 3/20 | 0.39 |
| ▸ | PPARA | Q07869 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1253782 | 0.90 | NR1H2 (0.38) | SLC6A4HTR2AKCNH2NR1H2NR1H3 | |
| SCHEMBL1253784 | 0.90 | NR1H2 (0.38) | SLC6A4HTR2AKCNH2NR1H2NR1H3 | |
| SCHEMBL1091550 | 0.88 | NR1H2 (0.42) | SLC6A4HTR2AKCNH2NR1H2NR1H3 | |
| SCHEMBL1092208 | 0.87 | NR1H2 (0.37) | SLC6A4HTR2AKCNH2NR1H2NR1H3 | |
| SCHEMBL1092641 | 0.87 | NR1H2 (0.41) | SLC6A4HTR2AKCNH2NR1H2NR1H3 | |
| SCHEMBL13601527 | 0.87 | NR1H2 (0.41) | SLC6A4HTR2AKCNH2NR1H2NR1H3 | |
| SCHEMBL1091996 | 0.87 | NR1H2 (0.38) | SLC6A4HTR2AKCNH2NR1H2NR1H3 | |
| SCHEMBL1091695 | 0.87 | NR1H2 (0.43) | SLC6A4HTR2AKCNH2NR1H2NR1H3 | |
| SCHEMBL1093280 | 0.86 | NR1H2 (0.43) | NR1H2NR1H3PPARGPPARDPPARA | |
| SCHEMBL1092330 | 0.86 | NR1H2 (0.39) | SLC6A4HTR2AKCNH2NR1H2NR1H3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2281817-A1 | SUBSTITUTED CARBINOL COMPOUND HAVING CYCLIC LINKER | Kowa Company, Ltd. (JP) | 2011-02-09 | — | — | EP | disclosed |