Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.32 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.32 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.32 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.32 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.32 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL6976227 | 0.96 | ALDH1A1 (0.35) | HSD11B1ALDH1A1PTGS2MAPK1 | |
| SCHEMBL6971212 | 0.87 | CYP1A2 (0.39) | HSD11B1SIGMAR1 | |
| SCHEMBL6980629 | 0.83 | APP (0.41) | ALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL6967893 | 0.78 | CNR1 (0.40) | CNR1CES2CES1HSD11B1ALDH1A1 | |
| SCHEMBL6983604 | 0.77 | OPRM1 (0.41) | ALDH1A1MAPK1 | |
| SCHEMBL6982434 | 0.74 | ALDH1A1 (0.44) | CNR1CES2CES1HSD11B1ALDH1A1 | |
| SCHEMBL377756 | 0.72 | MAPK1 (0.40) | CNR1HSD11B1ALDH1A1PTGS2MAPK1 | |
| SCHEMBL6970913 | 0.72 | OPRM1 (0.45) | ALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL6983251 | 0.71 | GAA (0.47) | ALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL6975621 | 0.71 | APP (0.38) | ALDH1A1PSEN1PSEN2APH1BNCSTN |
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-1098893-B1 | CYCLIC COMPOUNDS USEFUL IN THE TREATMENT OF DYSLIPIDEMIA, ATHEROSCLEROSIS AND DIABETES, PHARMACEUTICAL COMPOSITIONS AND PREPARATION PROCESS | MERCK PATENT GMBH (DE) | 2003-03-26 | — | — | EP | claimed |