Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 2/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.37 |
| ▸ | WNT3A | P56704 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2011909 | 1.00 | HCRTR1 (0.45) | HCRTR1HCRTR2NPC1RAB9AHDAC1 | |
| SCHEMBL2012515 | 0.83 | HCRTR1 (0.65) | HCRTR1HCRTR2NPC1RAB9AHDAC1 | |
| SCHEMBL2014754 | 0.83 | HCRTR1 (0.46) | HCRTR1HCRTR2NPC1RAB9ANAMPT | |
| SCHEMBL2014753 | 0.83 | HCRTR1 (0.46) | HCRTR1HCRTR2NPC1RAB9ANAMPT | |
| SCHEMBL2016048 | 0.81 | HCRTR1 (0.46) | HCRTR1HCRTR2NPC1RAB9AHDAC1 | |
| SCHEMBL2016049 | 0.81 | HCRTR1 (0.46) | HCRTR1HCRTR2NPC1RAB9AHDAC1 | |
| SCHEMBL2054156 | 0.73 | NPC1 (0.41) | HCRTR1HCRTR2NPC1RAB9AADRA1D | |
| SCHEMBL2012583 | 0.70 | HCRTR1 (0.64) | HCRTR1HCRTR2NPC1RAB9ACTNNB1 | |
| SCHEMBL2010943 | 0.69 | HCRTR1 (0.66) | HCRTR1HCRTR2NPC1RAB9AHDAC1 | |
| SCHEMBL2014120 | 0.68 | HCRTR1 (0.68) | HCRTR1HCRTR2NPC1RAB9AHDAC1 |
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 |