Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24890297 | 0.87 | ALDH1A1 (0.31) | NPC1 | |
| SCHEMBL22767174 | 0.87 | MEN1 (0.32) | ABCG2CYP1A1PAX8CYP1A2FYN | |
| SCHEMBL22901166 | 0.85 | PLA2G2A (0.33) | ABCG2CYP1A1PAX8CYP1A2FYN | |
| SCHEMBL24886757 | 0.84 | CYP1A1 (0.31) | ABCG2CYP1A1PAX8CYP1A2FYN | |
| SCHEMBL26570237 | 0.83 | P2RX7 (0.30) | — | |
| SCHEMBL24890270 | 0.83 | ALDH1A1 (0.31) | — | |
| SCHEMBL24889908 | 0.83 | — | — | |
| SCHEMBL24890179 | 0.83 | CYP1A1 (0.31) | CYP1A1CYP1B1TDP1L3MBTL1 | |
| SCHEMBL23946395 | 0.83 | — | — | |
| SCHEMBL24886817 | 0.82 | BACE1 (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020246835-A9 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2021-06-03 | — | — | WO | disclosed |
| WO-2020246835-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2020-12-10 | — | — | WO | disclosed |