Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 3/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | CASR | P41180 | 3/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL9824303 | 1.00 | CYP1A1 (0.44) | CYP1A1CYP1A2CYP1B1SLC2A1RELA | |
| SCHEMBL9825013 | 1.00 | CYP1A1 (0.44) | CYP1A1CYP1A2CYP1B1SLC2A1RELA | |
| SCHEMBL9824218 | 0.86 | SLC2A1 (0.48) | CYP1A1CYP1A2CYP1B1SLC2A1RELA | |
| SCHEMBL9824522 | 0.86 | SLC2A1 (0.48) | CYP1A1CYP1A2CYP1B1SLC2A1RELA | |
| SCHEMBL9824627 | 0.85 | SLC2A1 (0.50) | CYP1A1CYP1A2CYP1B1SLC2A1SIGMAR1 | |
| SCHEMBL9824526 | 0.85 | SLC2A1 (0.50) | CYP1A1CYP1A2CYP1B1SLC2A1SIGMAR1 | |
| SCHEMBL9824898 | 0.85 | SLC2A1 (0.50) | CYP1A1CYP1A2CYP1B1SLC2A1SIGMAR1 | |
| SCHEMBL9824503 | 0.81 | SLC2A1 (0.49) | CYP1A1CYP1A2CYP1B1SLC2A1SIGMAR1 | |
| SCHEMBL9824630 | 0.81 | SLC2A1 (0.49) | CYP1A1CYP1A2CYP1B1SLC2A1SIGMAR1 | |
| SCHEMBL10759050 | 0.81 | SLC2A1 (0.49) | CYP1A1CYP1A2CYP1B1SLC2A1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0250254-A1 | Cis & trans stilbenes and their composition for the treatment of hypertension | McNeilab, Inc. (US) | 1987-12-23 | — | — | EP | claimed |
| EP-0250254-B1 | CIS & TRANS STILBENES AND THEIR COMPOSITION FOR THE TREATMENT OF HYPERTENSION | McNeilab, Inc. (US) | 1991-06-19 | — | — | EP | disclosed |
| EP-0250254-A1 | Cis & trans stilbenes and their composition for the treatment of hypertension | McNeilab, Inc. (US) | 1987-12-23 | — | — | EP | disclosed |