Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 8/20 | 0.40 |
| ▸ | ESR1 | P03372 | 7/20 | 0.40 |
| ▸ | DRD1 | P21728 | 3/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2124644 | 0.91 | ESR2 (0.45) | ESR2ESR1DRD1GRIN1GRIN2B | |
| SCHEMBL5672055 | 0.88 | HRH3 (0.43) | — | |
| SCHEMBL4637682 | 0.82 | NR1H2 (0.46) | ESR2ESR1DRD1HTR2AGRIN1 | |
| SCHEMBL19638276 | 0.82 | CAMK2A (0.41) | ESR2ESR1CAMK2A | |
| SCHEMBL5170173 | 0.81 | ALDH1A1 (0.34) | GRIN1GRIN2B | |
| SCHEMBL5551729 | 0.81 | ESR1 (0.47) | ESR2ESR1DRD1GRIN1GRIN2B | |
| SCHEMBL2121104 | 0.80 | GHSR (0.41) | — | |
| SCHEMBL5170182 | 0.80 | HCRTR1 (0.32) | ESR2ESR1DRD1GRIN1GRIN2B | |
| SCHEMBL2120755 | 0.80 | DPP4 (0.38) | DRD2 | |
| SCHEMBL5669989 | 0.79 | ESR1 (0.38) | ESR2ESR1DRD1HTR2AGRIN1 |
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-1730114-A1 | BENZAZEPINE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS | GLAXO GROUP LIMITED (GB) | 2006-12-13 | — | — | EP | disclosed |
| WO-2005087746-A1 | BENZAZEPINE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS | GLAXO GROUP LIMITED (GB) | 2005-09-22 | — | — | WO | disclosed |