Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 7/20 | 0.48 |
| ▸ | HTR7 | P34969 | 4/20 | 0.45 |
| ▸ | DRD2 | P14416 | 5/20 | 0.45 |
| ▸ | DRD3 | P35462 | 4/20 | 0.45 |
| ▸ | DRD4 | P21917 | 2/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | DRD5 | P21918 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6993822 | 1.00 | HTR1A (0.48) | HTR1AHTR7DRD2DRD3DRD4 | |
| SCHEMBL7140268 | 0.92 | HTR1A (0.48) | HTR1AHTR7DRD2DRD3DRD4 | |
| SCHEMBL7140269 | 0.92 | HTR1A (0.48) | HTR1AHTR7DRD2DRD3DRD4 | |
| SCHEMBL7143237 | 0.91 | HTR1A (0.49) | HTR1AHTR7DRD2DRD3DRD4 | |
| SCHEMBL7143240 | 0.91 | HTR1A (0.49) | HTR1AHTR7DRD2DRD3DRD4 | |
| SCHEMBL6992914 | 0.86 | HTR1A (0.53) | HTR1AHTR7DRD2DRD3DRD4 | |
| SCHEMBL6987644 | 0.82 | DRD2 (0.48) | HTR1AHTR7DRD2DRD3DRD4 | |
| SCHEMBL6992529 | 0.82 | DRD2 (0.46) | HTR1AHTR7DRD2DRD3DRD4 | |
| SCHEMBL6987645 | 0.82 | DRD2 (0.48) | HTR1AHTR7DRD2DRD3DRD4 | |
| SCHEMBL6992521 | 0.82 | DRD2 (0.46) | HTR1AHTR7DRD2DRD3DRD4 |
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-0915881-B1 | PYRROLOAZEPINE COMPOUNDS | SUNTORY LTD (JP) | 2003-01-08 | — | — | EP | disclosed |
| US-6187772-B1 | Pyrroloazepine compounds | SUNTORY LIMITED (JP) | 2001-02-13 | — | — | US | disclosed |