Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPBWR1 | P48145 | 2/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 5/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.34 |
| ▸ | PPARD | Q03181 | 3/20 | 0.34 |
| ▸ | PPARA | Q07869 | 3/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | LIPE | Q05469 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4326943 | 0.90 | NPBWR1 (0.41) | NPBWR1MCHR1L3MBTL1POLBALDH1A1 | |
| SCHEMBL5264271 | 0.82 | MEN1 (0.36) | NPBWR1L3MBTL1ALDH1A1 | |
| SCHEMBL4319779 | 0.79 | NPBWR1 (0.47) | NPBWR1MCHR1L3MBTL1POLBALDH1A1 | |
| SCHEMBL4319898 | 0.79 | BCHE (0.43) | POLBALDH1A1CYP3A4TSHRPTGS2 | |
| SCHEMBL4332496 | 0.77 | NPBWR1 (0.47) | NPBWR1MCHR1L3MBTL1POLBALDH1A1 | |
| SCHEMBL4332003 | 0.74 | ALDH1A1 (0.44) | ALDH1A1HCRTR1HCRTR2TSHR | |
| SCHEMBL4320317 | 0.73 | ALDH1A1 (0.42) | NPBWR1MCHR1L3MBTL1POLBALDH1A1 | |
| SCHEMBL4335745 | 0.73 | FPR2 (0.38) | NPBWR1MCHR1ALDH1A1TRPV1 | |
| SCHEMBL4329502 | 0.72 | CHRM4 (0.48) | — | |
| SCHEMBL4326359 | 0.72 | DRD2 (0.48) | ALDH1A1HCRTR1HCRTR2 |
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-1833800-A1 | PYRAZOLONE COMPOUNDS AS METABOTROPIC GLUTAMATE RECEPTOR AGONISTS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS | AstraZeneca AB (SE) | 2007-09-19 | — | — | EP | disclosed |
| WO-2006071730-A1 | PYRAZOLONE COMPOUNDS AS METABOTROPIC GLUTAMATE RECEPTOR AGONISTS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS | ASTRAZENECA AB (SE) | 2006-07-06 | — | — | WO | disclosed |