Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 2/20 | 0.49 |
| ▸ | HTR2C | P28335 | 5/20 | 0.47 |
| ▸ | HTR7 | P34969 | 5/20 | 0.47 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 4/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.45 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6501747 | 0.89 | SIGMAR1 (0.53) | CYP26A1DGAT1HRH3DRD2SLC18A3 | |
| SCHEMBL8199307 | 0.87 | CYP26A1 (0.55) | CYP26A1HTR2CHTR7DRD2CHRM2 | |
| SCHEMBL8200537 | 0.87 | ADRA1D (0.56) | CYP26A1HTR2CHTR7DRD2SIGMAR1 | |
| SCHEMBL8200296 | 0.85 | ADRA1D (0.50) | CYP26A1HTR2CHTR7DRD2SIGMAR1 | |
| SCHEMBL8199275 | 0.85 | SIGMAR1 (0.50) | HTR2CHTR7DRD2CHRM2CHRM4 | |
| SCHEMBL8198980 | 0.85 | HTR2C (0.55) | HTR2CHTR7DRD2CHRM2CHRM4 | |
| SCHEMBL8199521 | 0.84 | DRD2 (0.58) | CYP26A1HTR2CHTR7DRD2SIGMAR1 | |
| SCHEMBL8190999 | 0.84 | HTR7 (0.52) | CYP26A1HTR2CHTR7HRH3DRD2 | |
| SCHEMBL8199033 | 0.84 | HTR2C (0.46) | HTR2CDGAT1DRD2DRD4DRD3 | |
| SCHEMBL8201012 | 0.83 | HTR2C (0.53) | HTR2CHTR7DRD2CHRM2CHRM4 |
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 |