Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 10/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8202807 | 1.00 | ADRA1D (0.46) | ADRA1DADRA1AADRA1BCD274GRIN1 | |
| SCHEMBL8202802 | 1.00 | ADRA1D (0.46) | ADRA1DADRA1AADRA1BCD274GRIN1 | |
| SCHEMBL6500564 | 0.91 | CD274 (0.47) | ADRA1DADRA1AADRA1BCD274GRIN1 | |
| SCHEMBL8198773 | 0.87 | GRIN1 (0.58) | ADRA1DADRA1AADRA1BGRIN1GRIN2B | |
| SCHEMBL8198776 | 0.87 | GRIN1 (0.58) | ADRA1DADRA1AADRA1BGRIN1GRIN2B | |
| SCHEMBL8198774 | 0.87 | GRIN1 (0.58) | ADRA1DADRA1AADRA1BGRIN1GRIN2B | |
| SCHEMBL8203170 | 0.82 | HRH3 (0.45) | ADRA1DADRA1AADRA1BGRIN1GRIN2B | |
| SCHEMBL8203174 | 0.82 | HRH3 (0.45) | ADRA1DADRA1AADRA1BGRIN1GRIN2B | |
| SCHEMBL8236868 | 0.82 | SLC6A9 (0.51) | GRIN1GRIN2B | |
| SCHEMBL8203171 | 0.82 | HRH3 (0.45) | ADRA1DADRA1AADRA1BGRIN1GRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| US-6048877-A | Tetralone derivatives as antiarrhythmic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 2000-04-11 | — | — | US | claimed |
| US-6048877-A | Tetralone derivatives as antiarrhythmic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 2000-04-11 | — | — | US | disclosed |