Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.59 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.40 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.40 |
| ▸ | PADI4 | Q9UM07 | 3/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2011717 | 1.00 | HCRTR1 (0.59) | HCRTR1HCRTR2NPC1RAB9AITGA4 | |
| SCHEMBL2054013 | 0.84 | HCRTR1 (0.62) | HCRTR1HCRTR2NPC1RAB9AITGA4 | |
| SCHEMBL2010795 | 0.84 | HCRTR1 (0.62) | HCRTR1HCRTR2NPC1RAB9AITGA4 | |
| SCHEMBL2019129 | 0.83 | HCRTR1 (0.59) | HCRTR1HCRTR2NPC1RAB9AITGA4 | |
| SCHEMBL2017211 | 0.83 | HCRTR1 (0.59) | HCRTR1HCRTR2NPC1RAB9AITGA4 | |
| SCHEMBL2014804 | 0.83 | HCRTR1 (0.58) | HCRTR1HCRTR2NPC1RAB9APADI4 | |
| SCHEMBL2013533 | 0.83 | HCRTR1 (0.60) | HCRTR1HCRTR2NPC1RAB9AITGA4 | |
| SCHEMBL2010990 | 0.83 | HCRTR1 (0.58) | HCRTR1HCRTR2NPC1RAB9APADI4 | |
| SCHEMBL2011939 | 0.83 | HCRTR1 (0.58) | HCRTR1HCRTR2NPC1RAB9APADI4 | |
| SCHEMBL2053258 | 0.82 | HCRTR1 (0.56) | HCRTR1HCRTR2NPC1RAB9APADI4 |
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 |