Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.60 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | PYGL | P06737 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | DRD3 | P35462 | 2/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2015645 | 0.90 | HCRTR1 (0.59) | HCRTR1HCRTR2KDM4EMAPTNPC1 | |
| SCHEMBL2052696 | 0.90 | HCRTR1 (0.59) | HCRTR1HCRTR2KDM4EMAPTNPC1 | |
| SCHEMBL2012240 | 0.89 | HCRTR1 (0.58) | HCRTR1HCRTR2NPC1RAB9APYGL | |
| SCHEMBL2012867 | 0.84 | HCRTR1 (0.59) | HCRTR1HCRTR2KDM4EMAPTNPC1 | |
| SCHEMBL2012866 | 0.84 | HCRTR1 (0.59) | HCRTR1HCRTR2KDM4EMAPTNPC1 | |
| SCHEMBL13139074 | 0.83 | HCRTR1 (0.84) | HCRTR1HCRTR2KDM4ENPC1RAB9A | |
| SCHEMBL13139077 | 0.83 | HCRTR1 (0.75) | HCRTR1HCRTR2MAPTNPC1RAB9A | |
| SCHEMBL2010990 | 0.82 | HCRTR1 (0.58) | HCRTR1HCRTR2KDM4EMAPTNPC1 | |
| SCHEMBL2011939 | 0.82 | HCRTR1 (0.58) | HCRTR1HCRTR2KDM4EMAPTNPC1 | |
| SCHEMBL2016380 | 0.81 | HCRTR1 (0.65) | HCRTR1HCRTR2NPC1RAB9AMEN1 |
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 |