Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7778608 | 0.92 | TDP1 (0.36) | L3MBTL1CYP1A2CYP2D6CYP2C19TDP1 | |
| SCHEMBL196443 | 0.88 | CYP3A4 (0.39) | L3MBTL1TDP1ALDH1A1TP53TSHR | |
| SCHEMBL30775610 | 0.84 | ACHE (0.35) | TDP1KDM4ENFE2L2ELANELMNA | |
| SCHEMBL30775606 | 0.80 | SMN1; SMN2 (0.38) | L3MBTL1CYP1A2TDP1ALDH1A1KDM4E | |
| SCHEMBL11728040 | 0.80 | KCNN4 (0.33) | TDP1TP53 | |
| SCHEMBL8336303 | 0.78 | ALDH1A1 (0.40) | L3MBTL1CYP1A2CYP2C19TDP1ALDH1A1 | |
| SCHEMBL30356626 | 0.77 | ACHE (0.39) | NFE2L2LMNA | |
| SCHEMBL7776013 | 0.77 | ACHE (0.39) | NFE2L2LMNA | |
| SCHEMBL8638207 | 0.74 | NFE2L2 (0.44) | L3MBTL1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL10709571 | 0.73 | ACHE (0.38) | CYP1A2CYP2C19TDP1ALDH1A1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117362338-A | Method for preparing 3, 3-diaryl allyl substituted organic phosphonate compound | 湖南理工学院 | 2024-01-09 | — | — | CN | claimed |
| CN-117362338-A | Method for preparing 3, 3-diaryl allyl substituted organic phosphonate compound | 湖南理工学院 | 2024-01-09 | — | — | CN | disclosed |