Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6971207 | 0.87 | OPRM1 (0.44) | NPC1MAPTMAPK1RAB9AKMT2A | |
| SCHEMBL6982681 | 0.86 | THRB (0.44) | MAPTKMT2AGAAKIF11ALDH1A1 | |
| SCHEMBL7816365 | 0.86 | MAPT (0.40) | MAPTMAPK1KMT2APOLBGAA | |
| SCHEMBL6975131 | 0.84 | MAPT (0.41) | NPC1MAPTMAPK1RAB9AKMT2A | |
| SCHEMBL6971210 | 0.83 | CYP1A2 (0.41) | RAB9AKMT2ASLC6A3TP53OPRM1 | |
| SCHEMBL6968252 | 0.80 | MEN1 (0.42) | MAPTKMT2APOLBGAAALDH1A1 | |
| SCHEMBL7823214 | 0.75 | KIF11 (0.36) | MAPTKIF11ALDH1A1PDK2 | |
| SCHEMBL7145811 | 0.75 | APP (0.38) | MAPTMAPK1KMT2AGAAOPRM1 | |
| SCHEMBL20091128 | 0.74 | CES2 (0.51) | NPC1MAPTMAPK1RAB9AKMT2A | |
| SCHEMBL6982212 | 0.73 | THRB (0.46) | MAPTKMT2APOLBALDH1A1PDK2 |
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 | disclosed |