Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.67 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.58 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 1/20 | 0.49 |
| ▸ | KMO | O15229 | 1/20 | 0.48 |
| ▸ | UNG | P13051 | 1/20 | 0.47 |
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | AXL | P30530 | 1/20 | 0.43 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.42 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28460866 | 0.93 | TRIM24 (0.67) | ALDH1A1CYP2A6TRIM24TRIM33CA12 | |
| SCHEMBL13617691 | 0.93 | ALDH1A1 (0.56) | ALDH1A1CYP2A6TRIM24TRIM33CA12 | |
| SCHEMBL29936396 | 0.93 | ALDH1A1 (0.56) | ALDH1A1CYP2A6TRIM24TRIM33CA12 | |
| SCHEMBL29936157 | 0.93 | ALDH1A1 (0.56) | ALDH1A1CYP2A6TRIM24TRIM33CA12 | |
| Benzaldehyde SCHEMBL6530259 | 0.93 | ALDH1A1 (0.64) | ALDH1A1CYP2A6TRIM24TRIM33CA12 | |
| SCHEMBL29414645 | 0.91 | TRIM24 (0.69) | ALDH1A1CYP2A6TRIM24TRIM33CA12 | |
| SCHEMBL97618 | 0.91 | TRIM24 (0.69) | ALDH1A1CYP2A6TRIM24TRIM33CA12 | |
| Biphenyl SCHEMBL2390667 | 0.90 | ALDH1A1 (0.82) | ALDH1A1CYP2A6TRIM24TRIM33CA12 | |
| Benzaldehyde SCHEMBL28675250 | 0.88 | ALDH1A1 (0.52) | ALDH1A1CYP2A6TRIM24TRIM33CA12 | |
| SCHEMBL1669178 | 0.88 | DRD1 (0.59) | ALDH1A1CYP2A6TRIM24TRIM33CA12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113831488-A | Fluorine-containing benzaldehyde-aromatic hydrocarbon polymer, electrolyte thereof, and preparation method and application of ion exchange membrane | 大连理工大学 | 2021-12-24 | — | — | CN | disclosed |