Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 7/20 | 0.50 |
| ▸ | MAOA | P21397 | 4/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 5/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31286361 | 0.87 | AHR (0.54) | AHRMAOAHRH4EGFRTTR | |
| SCHEMBL21302795 | 0.87 | AHR (0.54) | AHRMAOAHRH4EGFRTTR | |
| SCHEMBL21042330 | 0.86 | MAOA (0.40) | AHRMAOAEGFRTTR | |
| SCHEMBL23783951 | 0.81 | ESR2 (0.41) | AHRMAOAEGFRTTRCYP1A2 | |
| SCHEMBL21891043 | 0.81 | AHR (0.51) | AHRTTRCYP1A2CYP2A6 | |
| SCHEMBL31076340 | 0.81 | AHR (0.51) | AHRTTRCYP1A2CYP2A6 | |
| SCHEMBL22908125 | 0.80 | MAOA (0.41) | MAOAEGFR | |
| SCHEMBL22390212 | 0.80 | MAOA (0.36) | AHRMAOAEGFRTTR | |
| SCHEMBL8686 | 0.79 | ALOX5 (0.46) | AHRMAOA | |
| SCHEMBL22113586 | 0.79 | TTR (0.39) | AHRMAOAHRH4TTR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3480194-B1 | HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES USING SAME | LG CHEMICAL LTD (KR) | 2021-09-08 | — | — | EP | disclosed |
| EP-3480194-A1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | LG Chem, Ltd. (KR) | 2019-05-08 | — | — | EP | disclosed |
| WO-2018016742-A1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2018-01-25 | — | — | WO | disclosed |