Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 8/20 | 0.53 |
| ▸ | HTR1D | P28221 | 1/20 | 0.47 |
| ▸ | HTR1B | P28222 | 1/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 4/20 | 0.43 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8198980 | 0.92 | HTR2C (0.55) | HTR2CMCHR1SIGMAR1HTR7DRD2 | |
| SCHEMBL8200365 | 0.87 | HTR2C (0.51) | HTR2CMCHR1SIGMAR1HTR7DRD2 | |
| SCHEMBL8203362 | 0.87 | HTR2C (0.50) | HTR2CMCHR1SIGMAR1HTR7 | |
| SCHEMBL8204772 | 0.87 | HTR2C (0.50) | HTR2CMCHR1SIGMAR1HTR7DRD2 | |
| SCHEMBL8202320 | 0.86 | USP5 (0.52) | HTR2CMCHR1SIGMAR1DRD2 | |
| SCHEMBL8199307 | 0.85 | CYP26A1 (0.55) | HTR2CSIGMAR1HTR7DRD2SLC18A3 | |
| SCHEMBL8201042 | 0.85 | HTR2C (0.49) | HTR2CMCHR1SIGMAR1HTR7DRD2 | |
| SCHEMBL8200356 | 0.85 | HTR2C (0.49) | HTR2CMCHR1SIGMAR1HTR7DRD2 | |
| SCHEMBL8203440 | 0.85 | HTR2C (0.49) | HTR2CMCHR1SIGMAR1HTR7DRD2 | |
| SCHEMBL8199804 | 0.85 | HTR2C (0.49) | HTR2CMCHR1SIGMAR1DRD2 |
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 4 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 |
| WO-1998036749-A1 | TETRALONE DERIVATIVES AS ANTIARRHYTHMIC AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-08-27 | — | — | WO | disclosed |