Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.52 |
| ▸ | HTR2C | P28335 | 5/20 | 0.52 |
| ▸ | HTR2B | P41595 | 5/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.52 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.48 |
| ▸ | PTAFR | P25105 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 3/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9451756 | 0.87 | SIGMAR1 (0.71) | HTR2AHTR2CHTR2BSIGMAR1PTAFR | |
| SCHEMBL8312002 | 0.87 | SIGMAR1 (0.50) | HTR2AHTR2CHTR2BSIGMAR1ADRA1D | |
| SCHEMBL25345704 | 0.85 | CYP3A4 (0.49) | HTR2AHTR2CHTR2BSIGMAR1ADRA1D | |
| SCHEMBL8674607 | 0.83 | CRBN (0.53) | HTR2AHTR2CHTR2BSIGMAR1ADRA1D | |
| SCHEMBL27457057 | 0.83 | SIGMAR1 (0.73) | HTR2AHTR2CHTR2BSIGMAR1ADRA1D | |
| SCHEMBL25345710 | 0.82 | SIGMAR1 (0.47) | HTR2AHTR2CHTR2BSIGMAR1ADRA1D | |
| SCHEMBL16407589 | 0.82 | LMNA (0.50) | HTR2AHTR2CHTR2BSIGMAR1ADRA1D | |
| SCHEMBL1912719 | 0.81 | USP30 (0.47) | HTR2AHTR2CHTR2BSIGMAR1ADRA1D | |
| SCHEMBL8913591 | 0.81 | GFER (0.41) | USP2CYP2C19ALDH1A1MAPK1CYP3A4 | |
| SCHEMBL28502535 | 0.80 | ADRA1D (0.55) | HTR2AHTR2CHTR2BSIGMAR1ADRA1D |
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-5633247-A | ANTIARRTHYMIA AGENT | MERCK & CO., INC. (US) | 1997-05-27 | — | — | US | disclosed |
| US-5206240-A | Antiarrhythmia agents | MERCK & CO., INC. (US) | 1993-04-27 | — | — | US | disclosed |
| EP-0431943-A2 | Nitrogen-containing spirocycles | MERCK & CO. INC. (US) | 1991-06-12 | — | — | EP | disclosed |