Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.42 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.42 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25038456 | 0.91 | NPSR1 (0.40) | ADORA1HPGDADORA2AKDM4ENPSR1 | |
| SCHEMBL25038430 | 0.87 | ALDH1A1 (0.40) | ADORA1HPGDADORA2AKDM4ENPSR1 | |
| SCHEMBL25038373 | 0.87 | ALDH1A1 (0.40) | ADORA1HPGDADORA2AKDM4ENPSR1 | |
| SCHEMBL25038595 | 0.85 | CYP1A2 (0.39) | ADORA1HPGDADORA2AKDM4ENPSR1 | |
| SCHEMBL26553067 | 0.85 | ADORA1 (0.48) | ADORA1HPGDADORA2AKDM4ENPSR1 | |
| SCHEMBL25037964 | 0.84 | PIM1 (0.40) | ADORA1HPGDADORA2AKDM4ENPSR1 | |
| SCHEMBL25037984 | 0.84 | HSD17B10 (0.41) | ADORA1HPGDADORA2AKDM4ENPSR1 | |
| SCHEMBL25037970 | 0.84 | HSD17B10 (0.41) | ADORA1HPGDADORA2AKDM4ENPSR1 | |
| SCHEMBL25038437 | 0.84 | HSD17B10 (0.41) | ADORA1HPGDADORA2AKDM4ENPSR1 | |
| SCHEMBL25036001 | 0.83 | HSD17B10 (0.43) | ADORA1HPGDADORA2AKDM4ENPSR1 |
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-2023018267-A1 | NOVEL COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-02-16 | — | — | WO | disclosed |