Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.40 |
| ▸ | HPGDS | O60760 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13138938 | 1.00 | HCRTR1 (0.40) | HCRTR1HCRTR2HPGDSPDE10ASMN1; SMN2 | |
| SCHEMBL13138950 | 0.89 | HCRTR1 (0.43) | HCRTR1HCRTR2PDE10ASMN1; SMN2ALDH1A1 | |
| SCHEMBL6919279 | 0.86 | HCRTR1 (0.45) | HCRTR1HCRTR2PDE10ASMN1; SMN2HDAC1 | |
| SCHEMBL13139041 | 0.84 | HCRTR1 (0.45) | HCRTR1HCRTR2SMN1; SMN2MAPK14NPC1 | |
| SCHEMBL2013191 | 0.84 | HCRTR1 (0.40) | HCRTR1HCRTR2PDE10ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2013816 | 0.84 | HCRTR1 (0.45) | HCRTR1HCRTR2SMN1; SMN2MAPK14NPC1 | |
| SCHEMBL6917383 | 0.84 | HCRTR1 (0.40) | HCRTR1HCRTR2PDE10ASMN1; SMN2ALDH1A1 | |
| SCHEMBL13138972 | 0.83 | HCRTR1 (0.50) | HCRTR1HCRTR2PDE10ASMN1; SMN2ALDH1A1 | |
| SCHEMBL13138955 | 0.83 | GAA (0.42) | HCRTR1HCRTR2PDE10ASMN1; SMN2TSHR | |
| SCHEMBL13138957 | 0.83 | C5AR1 (0.41) | HCRTR1HCRTR2PDE10ASMN1; SMN2NPC1 |
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 |