Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 2/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | HTR2C | P28335 | 3/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.42 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8201035 | 1.00 | MCHR1 (0.46) | MCHR1SIGMAR1HTR2CDRD2SLC18A3 | |
| SCHEMBL8204780 | 0.89 | ACHE (0.44) | MCHR1SIGMAR1HTR2CDRD2 | |
| SCHEMBL8204778 | 0.89 | ACHE (0.44) | MCHR1SIGMAR1HTR2CDRD2 | |
| SCHEMBL8198980 | 0.89 | HTR2C (0.55) | MCHR1SIGMAR1HTR2CDRD2SLC18A3 | |
| SCHEMBL8201012 | 0.81 | HTR2C (0.53) | MCHR1SIGMAR1HTR2CDRD2SLC18A3 | |
| SCHEMBL8201273 | 0.80 | HTR2C (0.48) | MCHR1SIGMAR1HTR2CLMNA | |
| SCHEMBL8200365 | 0.79 | HTR2C (0.51) | MCHR1SIGMAR1HTR2CDRD2 | |
| SCHEMBL8204772 | 0.78 | HTR2C (0.50) | MCHR1SIGMAR1HTR2CDRD2 | |
| SCHEMBL8203362 | 0.78 | HTR2C (0.50) | MCHR1SIGMAR1HTR2CALDH1A1GAA | |
| SCHEMBL8205505 | 0.78 | HTR2C (0.50) | MCHR1SIGMAR1HTR2CDRD2 |
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 |