Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 9/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.37 |
| ▸ | TNF | P01375 | 2/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.34 |
| ▸ | TUBB | P07437 | 2/20 | 0.34 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.34 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.34 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16612656 | 0.92 | HCRTR2 (0.42) | HCRTR2HCRTR1HDAC3HDAC1HDAC2 | |
| SCHEMBL16612868 | 0.87 | MTNR1A (0.49) | HCRTR2HCRTR1HDAC3HDAC1HDAC2 | |
| SCHEMBL16612854 | 0.86 | MTNR1A (0.52) | HCRTR2HCRTR1HDAC3HDAC1HDAC2 | |
| SCHEMBL16612628 | 0.84 | HCRTR2 (0.43) | HCRTR2HCRTR1MTNR1AMTNR1B | |
| SCHEMBL16612982 | 0.84 | HCRTR2 (0.44) | HCRTR2HCRTR1MTNR1AMTNR1B | |
| SCHEMBL16612745 | 0.83 | HDAC6 (0.42) | HCRTR2HDAC1HDAC8HDAC6 | |
| SCHEMBL16613000 | 0.82 | HTR2A (0.42) | HCRTR2HCRTR1HDAC3HDAC1HDAC2 | |
| SCHEMBL16612997 | 0.82 | HCRTR2 (0.42) | HCRTR2HCRTR1TSHRHTTTRPM5 | |
| SCHEMBL16613026 | 0.80 | HDAC6 (0.40) | HCRTR2HDAC6TNFMTNR1AMTNR1B | |
| SCHEMBL16612936 | 0.80 | MTNR1A (0.50) | HCRTR2MTNR1AMTNR1B |
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 |