Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.50 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.50 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.45 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Cyclopropane SCHEMBL2826295 | 1.00 | HRH3 (0.50) | HRH3PDE7APTPN11MAPTKDM4E | |
| Cyclopentane SCHEMBL2825703 | 1.00 | HRH3 (0.50) | HRH3PDE7APTPN11MAPTKDM4E | |
| SCHEMBL2830938 | 1.00 | HRH3 (0.50) | HRH3PDE7APTPN11MAPTKDM4E | |
| SCHEMBL2827804 | 0.86 | MEN1 (0.52) | HRH3MAPTKDM4ERAB9AALDH1A1 | |
| SCHEMBL2828759 | 0.84 | MAPT (0.55) | HRH3MAPTKDM4ERAB9AALDH1A1 | |
| Cyclohexane SCHEMBL13372663 | 0.84 | DGAT1 (0.61) | PDE7AMAPTKDM4EL3MBTL1RAB9A | |
| SCHEMBL2829488 | 0.84 | ALDH1A1 (0.52) | HRH3PDE7AMAPTKDM4EL3MBTL1 | |
| SCHEMBL2825785 | 0.83 | KDM4E (0.48) | HRH3PTPN11MAPTKDM4EL3MBTL1 | |
| SCHEMBL2826032 | 0.83 | KDM4E (0.49) | HRH3MAPTKDM4EALDH1A1DGAT1 | |
| SCHEMBL2825546 | 0.83 | WNT3A (0.52) | HRH3MAPTKDM4ERAB9AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1824829-B1 | 3-SUBSTITUTED PYRIDINE DERIVATIVES AS H3 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-05-05 | — | — | EP | claimed |