Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 3/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 11/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 11/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 11/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.41 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.41 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.41 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.41 |
| ▸ | CYP2C18 | P33260 | 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 | |
|---|---|---|---|---|
| SCHEMBL11530716 | 1.00 | RELA (0.48) | RELANFE2L2CYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11526820 | 0.83 | NFE2L2 (0.54) | RELANFE2L2CYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11526818 | 0.83 | NFE2L2 (0.54) | RELANFE2L2CYP1A1CYP1B1CYP1A2 | |
| SCHEMBL473882 | 0.82 | SLC6A4 (0.46) | KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL29976707 | 0.82 | SLC6A4 (0.46) | KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL11525531 | 0.80 | RELA (0.53) | RELANFE2L2CYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11525535 | 0.80 | RELA (0.53) | RELANFE2L2CYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11530957 | 0.78 | NFE2L2 (0.40) | RELANFE2L2CYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11530952 | 0.78 | NFE2L2 (0.40) | RELANFE2L2CYP1A1CYP1B1CYP1A2 | |
| SCHEMBL11530747 | 0.77 | RELA (0.62) | RELANFE2L2CYP1A1CYP1B1CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4153719-A | Aromatic diketones | STERLING DRUG INC. (US) | 1979-05-08 | — | — | US | disclosed |