Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25038419 | 0.95 | XDH (0.40) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 | |
| SCHEMBL25038477 | 0.93 | ALDH1A1 (0.39) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 | |
| SCHEMBL25036112 | 0.93 | ALDH1A1 (0.39) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 | |
| SCHEMBL25036119 | 0.92 | ALDH1A1 (0.39) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 | |
| SCHEMBL25036116 | 0.92 | XDH (0.39) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 | |
| SCHEMBL25038599 | 0.91 | XDH (0.44) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 | |
| SCHEMBL25038445 | 0.91 | MCL1 (0.34) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 | |
| SCHEMBL25038877 | 0.90 | CYP11B1 (0.36) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 | |
| SCHEMBL25038634 | 0.90 | XDH (0.45) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 | |
| SCHEMBL25038883 | 0.90 | MCL1 (0.35) | MCL1CYP1A2CYP2C9CYP2C19CYP11B1 |
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 |