Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.46 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 6/20 | 0.40 |
| ▸ | DRD2 | P14416 | 5/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 4/20 | 0.40 |
| ▸ | HTR2C | P28335 | 4/20 | 0.40 |
| ▸ | HTR1A | P08908 | 3/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 5/20 | 0.39 |
| ▸ | CBLB | Q13191 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2016048 | 1.00 | HCRTR1 (0.46) | HCRTR1HCRTR2NPC1RAB9ADRD3 | |
| SCHEMBL2014753 | 0.90 | HCRTR1 (0.46) | HCRTR1HCRTR2NPC1RAB9ADRD3 | |
| SCHEMBL2014754 | 0.90 | HCRTR1 (0.46) | HCRTR1HCRTR2NPC1RAB9ADRD3 | |
| SCHEMBL2013516 | 0.83 | HCRTR1 (0.66) | HCRTR1HCRTR2NPC1RAB9ADRD3 | |
| SCHEMBL6918071 | 0.83 | HCRTR1 (0.66) | HCRTR1HCRTR2NPC1RAB9ADRD3 | |
| SCHEMBL2011913 | 0.81 | HCRTR1 (0.45) | HCRTR1HCRTR2NPC1RAB9AHDAC3 | |
| SCHEMBL2011909 | 0.81 | HCRTR1 (0.45) | HCRTR1HCRTR2NPC1RAB9AHDAC3 | |
| SCHEMBL2054156 | 0.74 | NPC1 (0.41) | HCRTR1HCRTR2NPC1RAB9A | |
| SCHEMBL2013785 | 0.73 | HCRTR1 (0.67) | HCRTR1HCRTR2NPC1RAB9ADRD3 | |
| SCHEMBL2050042 | 0.72 | NPC1 (0.38) | HCRTR1HCRTR2NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011073316-A1 | 4-ARYL-BUTANE-1,3-DIAMIDES | NOVARTIS AG (CH) | 2011-06-23 | — | — | WO | disclosed |