Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 6/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.44 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 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 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL24028817 | 0.88 | L3MBTL1 (0.51) | AHRCYP1A2CYP1A1PAX8FYN | |
| SCHEMBL24029169 | 0.85 | AHR (0.44) | AHRCYP1A2CYP1A1PAX8FYN | |
| SCHEMBL24028982 | 0.83 | AHR (0.42) | AHRCYP1A2CYP1A1PAX8FYN | |
| SCHEMBL24029286 | 0.81 | CYP1A1 (0.49) | CYP1A2CYP1A1PAX8ABCG2CYP2A6 | |
| SCHEMBL21331568 | 0.79 | AHR (0.54) | AHRCYP1A2CYP1A1PAX8FYN | |
| SCHEMBL15667149 | 0.79 | AHR (0.57) | AHRCYP1A2CYP1A1PAX8FYN | |
| SCHEMBL29597535 | 0.79 | AHR (0.57) | AHRCYP1A2CYP1A1PAX8FYN | |
| SCHEMBL24156128 | 0.79 | AHR (0.46) | AHRCYP1A2CYP1A1PAX8FYN | |
| SCHEMBL415466 | 0.78 | TDP1 (0.55) | AHRCYP1A2CYP1A1PAX8FYN | |
| SCHEMBL30091394 | 0.78 | TDP1 (0.55) | AHRCYP1A2CYP1A1PAX8FYN |
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-2021230654-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2021-11-18 | — | — | WO | disclosed |