Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Methacrylic Acid SCHEMBL25408913 | 0.89 | THRA (0.31) | TLR8CYP3A4 | |
| SCHEMBL59762 | 0.80 | ALDH1A1 (0.48) | ALDH1A1CYP3A4MAPK1 | |
| SCHEMBL7484743 | 0.72 | CYP3A4 (0.31) | CYP3A4MAPK1 | |
| 1,2-Dichlorobenzene SCHEMBL28051530 | 0.68 | ALDH1A1 (0.52) | ALDH1A1TLR8SMN1; SMN2LMNAHSD17B10 | |
| SCHEMBL16934003 | 0.68 | ALDH1A1 (0.44) | ALDH1A1CYP3A4MAPK1 | |
| Butyl Alcohol SCHEMBL28262536 | 0.66 | — | — | |
| Butyl Alcohol SCHEMBL27771107 | 0.66 | — | — | |
| Butyl Alcohol SCHEMBL23631737 | 0.66 | TP53 (0.56) | ALDH1A1TLR8CYP3A4SMN1; SMN2LMNA | |
| Styrene SCHEMBL5863615 | 0.66 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1 | |
| Pentane SCHEMBL27715496 | 0.66 | ALDH1A1 (0.72) | ALDH1A1SMN1; SMN2LMNATSHR |
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-2023159843-A1 | HIERARCHICAL PORE STRUCTURE POLYMER MATERIAL AND PREPARATION METHOD THEREFOR | 陕西师范大学 | 2023-08-31 | — | — | WO | disclosed |