Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL16612857 | 0.84 | MTNR1A (0.44) | HRH3MTNR1AMTNR1BPARP1 | |
| SCHEMBL16612728 | 0.82 | NR3C2 (0.43) | NR3C2TAAR1DAOPARP1MAOB | |
| SCHEMBL16612770 | 0.76 | ADRB2 (0.44) | MTNR1AMTNR1B | |
| SCHEMBL12479180 | 0.76 | MTNR1A (0.55) | HRH3MTNR1AMTNR1B | |
| SCHEMBL15520091 | 0.75 | CACNA1G (0.43) | HDAC1PARP1 | |
| SCHEMBL16612868 | 0.74 | MTNR1A (0.49) | MTNR1AMTNR1BHDAC1MAOAMAOB | |
| SCHEMBL16612866 | 0.73 | HCRTR2 (0.41) | NR3C2 | |
| SCHEMBL16612856 | 0.73 | MTNR1A (0.54) | MTNR1AMTNR1B | |
| SCHEMBL16612828 | 0.72 | SIRT2 (0.39) | HDAC1PARP1MAOBHDAC6 | |
| SCHEMBL16612936 | 0.72 | MTNR1A (0.50) | MTNR1AMTNR1B |
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-2675801-B1 | NOVEL PYRAZOLE AND IMIDAZOLE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2015-04-08 | — | — | EP | claimed |