Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 14/20 | 0.50 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8800208 | 1.00 | PARP1 (0.50) | PARP1HTR6HTR2AHTR2CHTR2B | |
| SCHEMBL8799810 | 1.00 | PARP1 (0.50) | PARP1HTR6HTR2AHTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL8800428 | 0.99 | PARP1 (0.49) | PARP1HTR6HTR2AHTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL8801830 | 0.99 | PARP1 (0.49) | PARP1HTR6HTR2AHTR2CHTR2B | |
| Water SCHEMBL8798203 | 0.99 | PARP1 (0.49) | PARP1HTR6HTR2AHTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL8800877 | 0.99 | PARP1 (0.49) | PARP1HTR6HTR2AHTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL8799094 | 0.97 | PARP1 (0.48) | PARP1HTR6HTR2AHTR2CHTR2B | |
| Cadaverine Tartrate SCHEMBL8800774 | 0.90 | PARP1 (0.41) | PARP1HTR6PARP3ALDH1A1GAA | |
| Cadaverine Tartrate SCHEMBL8801759 | 0.90 | PARP1 (0.41) | PARP1HTR6PARP3ALDH1A1GAA | |
| SCHEMBL8798434 | 0.84 | PARP1 (0.48) | PARP1HTR2AHTR2CHTR2BMAPT |
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-0525584-B1 | 6-Oxo-azepinoindole derivatives, process and intermediates for their preparation and medicaments containing them | SOLVAY PHARM GMBH (DE) | 1997-12-10 | — | — | EP | disclosed |
| US-5272143-A | 6-oxoazepinoindole compounds, and pharmaceutical compositions containing them | KALI-CHEMIE PHARMA GMBH (DE) | 1993-12-21 | — | — | US | disclosed |