Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 9/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25038611 | 0.99 | CYP1A2 (0.40) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL25038564 | 0.96 | CYP1A2 (0.40) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL25038635 | 0.94 | ALDH1A1 (0.39) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL25037914 | 0.93 | CYP1A2 (0.39) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL25038637 | 0.92 | CYP1A2 (0.39) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL25038625 | 0.91 | CYP1A2 (0.36) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL25037945 | 0.91 | CYP1A2 (0.41) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL25038561 | 0.90 | CYP1A2 (0.37) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL25037915 | 0.90 | CYP1A2 (0.37) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL25037987 | 0.90 | CYP1A2 (0.40) | CYP1A2CYP3A4ALDH1A1HSD17B10MEN1 |
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-2023018267-A1 | NOVEL COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-02-16 | — | — | WO | disclosed |