Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 7/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25874355 | 0.93 | CYP1A2 (0.47) | CYP1A2CYP3A4MEN1ALDH1A1CYP2C19 | |
| SCHEMBL25651189 | 0.85 | PDE10A (0.43) | CYP1A2MEN1ALDH1A1KMT2ATSHR | |
| SCHEMBL25875848 | 0.84 | CYP1A2 (0.43) | CYP1A2CYP3A4MEN1ALDH1A1CYP2C19 | |
| SCHEMBL25874359 | 0.84 | SLC22A12 (0.42) | CYP1A2CYP3A4MEN1ALDH1A1CYP2C19 | |
| SCHEMBL25769007 | 0.84 | MAPK1 (0.48) | CYP1A2MEN1ALDH1A1KMT2ATSHR | |
| SCHEMBL25874699 | 0.83 | RPS6KB1 (0.43) | CYP1A2CYP3A4MEN1ALDH1A1CYP2C19 | |
| SCHEMBL25651510 | 0.82 | PDE10A (0.41) | CYP1A2MEN1ALDH1A1KMT2APPARG | |
| SCHEMBL25874595 | 0.82 | RPS6KB1 (0.43) | CYP1A2CYP3A4MEN1ALDH1A1CYP2C19 | |
| SCHEMBL23105412 | 0.81 | PDE10A (0.47) | CYP1A2MEN1ALDH1A1KMT2ATSHR | |
| SCHEMBL25864801 | 0.80 | ESR1 (0.41) | CYP1A2MEN1ALDH1A1KMT2APPARG |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023140649-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2023-07-27 | — | — | WO | disclosed |