Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 6/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25038626 | 0.91 | XDH (0.41) | XDHGRM5ALDH1A1KDM4EHTT | |
| SCHEMBL25037935 | 0.91 | XDH (0.41) | XDHGRM5ALDH1A1KDM4EHTT | |
| SCHEMBL25038608 | 0.91 | ADORA2A (0.37) | XDHGRM5ALDH1A1KDM4EHTT | |
| SCHEMBL25038655 | 0.91 | XDH (0.37) | XDHALDH1A1KDM4EHTTRXFP1 | |
| SCHEMBL25037878 | 0.90 | XDH (0.42) | XDHGRM5ALDH1A1KDM4EHTT | |
| SCHEMBL26581946 | 0.90 | XDH (0.43) | XDHGRM5ALDH1A1KDM4EHTT | |
| SCHEMBL25037991 | 0.89 | SSTR2 (0.33) | ALDH1A1CYP1A2CYP2C9CYP2C19NPSR1 | |
| SCHEMBL25038878 | 0.89 | CYP11B1 (0.34) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL25036059 | 0.87 | TRPA1 (0.34) | ALDH1A1KDM4EHTTRXFP1LMNA | |
| SCHEMBL25036148 | 0.86 | CYP11B1 (0.35) | XDHALDH1A1KDM4EHTTRXFP1 |
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 |