Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 4/20 | 0.45 |
| ▸ | HTR2A | P28223 | 4/20 | 0.45 |
| ▸ | HTR2C | P28335 | 4/20 | 0.45 |
| ▸ | HTR2B | P41595 | 3/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.45 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.42 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8198852 | 0.91 | ADRA1D (0.57) | ADRA1DADRA1AADRA1BDRD2HTR2A | |
| SCHEMBL8199711 | 0.91 | ADRA1D (0.53) | ADRA1DADRA1AADRA1BDRD2HTR2A | |
| SCHEMBL8200296 | 0.86 | ADRA1D (0.50) | ADRA1DADRA1AADRA1BDRD2HTR2A | |
| SCHEMBL8200537 | 0.86 | ADRA1D (0.56) | ADRA1DADRA1AADRA1BDRD2HTR2A | |
| SCHEMBL8192983 | 0.86 | ADRA1D (0.49) | ADRA1DADRA1AADRA1BDRD2HTR2A | |
| SCHEMBL8199674 | 0.86 | MAOB (0.50) | ADRA1DADRA1AADRA1BDRD2HTR2A | |
| SCHEMBL8199290 | 0.85 | ADRA1D (0.55) | ADRA1DADRA1AADRA1BDRD2HTR2A | |
| SCHEMBL8192734 | 0.85 | ADRA1D (0.55) | ADRA1DADRA1AADRA1BDRD2HTR2A | |
| SCHEMBL8192177 | 0.85 | HTR2C (0.54) | ADRA1DADRA1AADRA1BDRD2HTR2A | |
| SCHEMBL6491492 | 0.84 | ADRA1D (0.54) | ADRA1DADRA1AADRA1BDRD2HTR2A |
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 3 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 |
| WO-1998036749-A1 | TETRALONE DERIVATIVES AS ANTIARRHYTHMIC AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-08-27 | — | — | WO | claimed |
| US-6048877-A | Tetralone derivatives as antiarrhythmic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 2000-04-11 | — | — | US | disclosed |