Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 5/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | FASN | P49327 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | SSTR2 | P30874 | 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 | |
|---|---|---|---|---|
| SCHEMBL25038498 | 0.90 | XDH (0.39) | XDHGRM5TRPA1GABRG2GABRB3 | |
| SCHEMBL25037880 | 0.89 | XDH (0.40) | XDHGRM5TRPA1ALDH1A1KDM4E | |
| SCHEMBL25038667 | 0.89 | ATM (0.39) | XDHGRM5GABRG2GABRB3GABRA5 | |
| SCHEMBL25038349 | 0.89 | MCL1 (0.36) | XDHFASNALDH1A1KDM4ELMNA | |
| SCHEMBL25038473 | 0.88 | XDH (0.38) | XDHGRM5ALDH1A1KDM4ELMNA | |
| SCHEMBL25036057 | 0.87 | MCL1 (0.37) | XDHTRPA1GABRG2GABRB3FASN | |
| SCHEMBL25037883 | 0.86 | XDH (0.39) | XDHGRM5TRPA1ALDH1A1KDM4E | |
| SCHEMBL25038620 | 0.86 | XDH (0.42) | XDHGRM5ESR2ALDH1A1KDM4E | |
| SCHEMBL25038526 | 0.86 | ADORA2A (0.37) | XDHTRPA1FASNALDH1A1KDM4E | |
| SCHEMBL25038518 | 0.86 | NPSR1 (0.36) | XDHGRM5TRPA1GABRG2GABRB3 |
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 |