Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.53 |
| ▸ | THRA | P10827 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | CYP27A1 | Q02318 | 1/20 | 0.46 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8200489 | 0.86 | CYP24A1 (0.48) | THRATHRBHTR2CCYP27A1CYP24A1 | |
| SCHEMBL8200598 | 0.81 | CYP26A1 (0.52) | HRH3HTR2CCYP27A1CYP24A1HTR7 | |
| SCHEMBL8200350 | 0.78 | THRA (0.49) | THRATHRBHTR2CCYP27A1CYP24A1 | |
| Hydrochloric Acid SCHEMBL4623367 | 0.76 | CYP24A1 (0.57) | HTR2CCYP27A1CYP24A1 | |
| SCHEMBL5904289 | 0.75 | CYP24A1 (0.59) | HTR2CCYP27A1CYP24A1 | |
| SCHEMBL6265784 | 0.75 | METAP1 (0.60) | HTR2CACHEHTR7 | |
| SCHEMBL8199521 | 0.74 | DRD2 (0.58) | HTR2CCYP27A1CYP24A1HTR7 | |
| SCHEMBL8204752 | 0.74 | HTR7 (0.47) | HTR2CCYP27A1CYP24A1HTR7 | |
| SCHEMBL8198852 | 0.74 | ADRA1D (0.57) | HRH3HTR2CCYP27A1CYP24A1HTR7 | |
| SCHEMBL8202791 | 0.74 | MAOA (0.58) | HRH3CYP24A1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |