Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.64 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.64 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 10/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 9/20 | 0.42 |
| ▸ | CDC7 | O00311 | 2/20 | 0.40 |
| ▸ | PLK4 | O00444 | 2/20 | 0.40 |
| ▸ | AURKA | O14965 | 2/20 | 0.40 |
| ▸ | PRKCG | P05129 | 2/20 | 0.40 |
| ▸ | CDK1 | P06493 | 2/20 | 0.40 |
| ▸ | PRKACA | P17612 | 2/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.40 |
| ▸ | CDK2 | P24941 | 2/20 | 0.40 |
| ▸ | AKT1 | P31749 | 2/20 | 0.40 |
| ▸ | GSK3A | P49840 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | IRAK1 | P51617 | 2/20 | 0.40 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.40 |
| ▸ | PRKX | P51817 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2012515 | 0.87 | HCRTR1 (0.65) | HCRTR1HCRTR2NPC1RAB9ACTNNB1 | |
| SCHEMBL2010961 | 0.85 | HCRTR1 (0.64) | HCRTR1HCRTR2NPC1RAB9A | |
| SCHEMBL2012638 | 0.85 | HCRTR1 (0.64) | HCRTR1HCRTR2NPC1RAB9AMAOB | |
| SCHEMBL2017845 | 0.84 | HCRTR1 (0.68) | HCRTR1HCRTR2NPC1RAB9AMAOB | |
| SCHEMBL2014120 | 0.84 | HCRTR1 (0.68) | HCRTR1HCRTR2NPC1RAB9AMAOB | |
| SCHEMBL2010943 | 0.84 | HCRTR1 (0.66) | HCRTR1HCRTR2NPC1RAB9AMAPK1 | |
| SCHEMBL13139060 | 0.83 | HCRTR1 (0.77) | HCRTR1HCRTR2NPC1RAB9A | |
| SCHEMBL2011910 | 0.83 | HCRTR1 (0.69) | HCRTR1HCRTR2NPC1RAB9A | |
| SCHEMBL2013785 | 0.83 | HCRTR1 (0.67) | HCRTR1HCRTR2NPC1RAB9A | |
| SCHEMBL2013516 | 0.83 | HCRTR1 (0.66) | 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 2 patents. 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 | claimed |
| WO-2011073316-A1 | 4-ARYL-BUTANE-1,3-DIAMIDES | NOVARTIS AG (CH) | 2011-06-23 | — | — | WO | disclosed |