Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.44 |
| ▸ | TYMS | P04818 | 2/20 | 0.41 |
| ▸ | PDE6D | O43924 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24277586 | 1.00 | KDM4E (0.44) | KDM4EMAPK1ATMTYMSPDE6D | |
| SCHEMBL24277581 | 1.00 | KDM4E (0.44) | KDM4EMAPK1ATMTYMSPDE6D | |
| SCHEMBL24277449 | 1.00 | KDM4E (0.44) | KDM4EMAPK1ATMTYMSPDE6D | |
| SCHEMBL24277758 | 0.99 | MAPK1 (0.45) | KDM4EMAPK1ATMTYMSPDE6D | |
| SCHEMBL24277759 | 0.99 | MAPK1 (0.45) | KDM4EMAPK1ATMTYMSPDE6D | |
| SCHEMBL24277446 | 0.99 | MAPK1 (0.45) | KDM4EMAPK1ATMTYMSPDE6D | |
| SCHEMBL24277451 | 0.99 | MAPK1 (0.45) | KDM4EMAPK1ATMTYMSPDE6D | |
| SCHEMBL24277753 | 0.92 | KDM4E (0.40) | KDM4EMAPK1ATMTYMSALDH1A1 | |
| SCHEMBL24277756 | 0.92 | KDM4E (0.40) | KDM4EMAPK1ATMTYMSALDH1A1 | |
| SCHEMBL24277453 | 0.91 | KDM4E (0.39) | KDM4EMAPK1ATMTYMS |
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-2022050533-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2022-03-10 | — | — | WO | disclosed |