Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | AHR | P35869 | 3/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31344520 | 1.00 | CA1 (0.49) | CA1CA2TDP1L3MBTL1AHR | |
| SCHEMBL10122751 | 1.00 | CA1 (0.49) | CA1CA2TDP1L3MBTL1AHR | |
| SCHEMBL29706683 | 1.00 | CA1 (0.49) | CA1CA2TDP1L3MBTL1AHR | |
| SCHEMBL9102586 | 0.89 | CA1 (0.50) | CA1CA2TDP1L3MBTL1AHR | |
| SCHEMBL30317436 | 0.89 | CA1 (0.50) | CA1CA2TDP1L3MBTL1AHR | |
| SCHEMBL18819391 | 0.88 | CA1 (0.42) | CA1CA2TDP1L3MBTL1AHR | |
| SCHEMBL16067560 | 0.81 | CA1 (0.49) | CA1CA2TDP1L3MBTL1PAX8 | |
| SCHEMBL2128544 | 0.80 | AHR (0.53) | CA1CA2AHRCYP1A2NPC1 | |
| Boric Acid SCHEMBL31598907 | 0.80 | TDP1 (0.56) | TDP1L3MBTL1AHRPAX8ABCG2 | |
| SCHEMBL10122756 | 0.79 | CA1 (0.53) | CA1CA2TDP1AHRNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117279912-A | Compound, material for organic electroluminescent element, and electronic device | 出光兴产株式会社 | 2023-12-22 | — | — | CN | disclosed |
| CN-114573533-A | Novel compound for capping layer and organic light-emitting element including same | 东进世美肯株式会社 | 2022-06-03 | — | — | CN | disclosed |