Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.47 |
| ▸ | HTR1A | P08908 | 4/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.47 |
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 3/20 | 0.42 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5268003 | 0.90 | SIGMAR1 (0.53) | SIGMAR1HTR1AKCNH2PARP1MEN1 | |
| SCHEMBL5265876 | 0.88 | SIGMAR1 (0.48) | SIGMAR1HTR1AKCNH2PARP1HTR7 | |
| SCHEMBL5268778 | 0.86 | MEN1 (0.48) | SIGMAR1HTR1AKCNH2MEN1KMT2A | |
| SCHEMBL5265027 | 0.83 | DRD4 (0.47) | SIGMAR1HTR1AKCNH2HTR7 | |
| SCHEMBL5264352 | 0.83 | SMN1; SMN2 (0.55) | HTR1AMEN1KMT2AHTR7 | |
| SCHEMBL5262999 | 0.81 | DRD2 (0.54) | HTR1AHTR7 | |
| SCHEMBL5270524 | 0.80 | MEN1 (0.54) | HTR1AMEN1KMT2AHTR7 | |
| SCHEMBL5265038 | 0.80 | OPRM1 (0.54) | SIGMAR1HTR1AKCNH2HTR7 | |
| SCHEMBL5265183 | 0.80 | DRD4 (0.48) | SIGMAR1HTR1AMEN1KMT2AHTR7 | |
| SCHEMBL5270523 | 0.80 | ADRA1B (0.54) | SIGMAR1HTR1AKCNH2MEN1KMT2A |
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 |