Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 3/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | APAF1 | O14727 | 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 | |
|---|---|---|---|---|
| SCHEMBL25038457 | 0.93 | XDH (0.37) | XDHMCL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL25038588 | 0.92 | XDH (0.46) | XDHMCL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL25038571 | 0.92 | XDH (0.39) | XDHMCL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL25038553 | 0.91 | XDH (0.41) | XDHMCL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL25038636 | 0.91 | XDH (0.45) | XDHMCL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL25038622 | 0.91 | XDH (0.46) | XDHMCL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL25038620 | 0.89 | XDH (0.42) | XDHCYP1A2CYP2C9CYP2C19GRM5 | |
| SCHEMBL25038551 | 0.88 | XDH (0.46) | XDHMCL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL25038589 | 0.88 | XDH (0.41) | XDHMCL1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL25038586 | 0.88 | XDH (0.46) | XDHMCL1CYP1A2CYP2C9CYP2C19 |
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 |