Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 3/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.38 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.38 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.38 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.38 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.38 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.38 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 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 | |
|---|---|---|---|---|
| SCHEMBL28405339 | 0.85 | HRH3 (0.43) | HCRTR1ALDH1A1MEN1KMT2APRKAB2 | |
| SCHEMBL22877015 | 0.78 | KDM4E (0.50) | HCAR3PDGFRBPDGFRAKDM4EALDH1A1 | |
| SCHEMBL14349199 | 0.75 | HCAR3 (0.54) | HCAR3PDGFRBPDGFRAKDM4EALDH1A1 | |
| SCHEMBL26866959 | 0.74 | HCAR3 (0.42) | HCAR3HCRTR1 | |
| SCHEMBL14349202 | 0.73 | HCAR3 (0.53) | HCAR3PDGFRBPDGFRAKDM4EALDH1A1 | |
| SCHEMBL22877066 | 0.73 | HCAR3 (0.39) | HCAR3PDGFRBPDGFRAHCRTR1KDM4E | |
| SCHEMBL18607516 | 0.73 | HCAR3 (0.47) | HCAR3PDGFRBPDGFRAKDM4EALDH1A1 | |
| SCHEMBL31737288 | 0.73 | ALDH1A1 (0.41) | HCRTR1KDM4EALDH1A1HRH4 | |
| SCHEMBL22877248 | 0.72 | HCAR3 (0.44) | HCAR3PDGFRBPDGFRAHCRTR1KDM4E | |
| SCHEMBL22877206 | 0.71 | HCAR3 (0.46) | HCAR3PDGFRBPDGFRAHCRTR1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3107898-B1 | 1,2-SUBSTITUTED CYCLOPENTANES AS OREXIN RECEPTOR ANTAGONISTS | TAKEDA PHARMACEUTICALS CO (JP) | 2021-01-06 | — | — | EP | disclosed |
| WO-2015124932-A1 | 1,2-SUBSTITUTED CYCLOPENTANES AS OREXIN RECEPTOR ANTAGONISTS | TAKEDA CAMBRIDGE LIMITED (GB) | 2015-08-27 | — | — | WO | disclosed |