Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30536567 | 0.79 | PDE4A (0.41) | ALDH1A1TDP1LMNASLC1A3SLC1A2 | |
| SCHEMBL28400548 | 0.78 | CYP2D6 (0.51) | ALDH1A1MAPK1LMNASLC1A3SLC1A2 | |
| Mannitol SCHEMBL29234138 | 0.76 | L3MBTL1 (0.42) | ALDH1A1MAPK1TDP1LMNASLC1A3 | |
| SCHEMBL27822256 | 0.76 | HTT (0.43) | ALDH1A1LMNAPOLBTSHRMAPT | |
| SCHEMBL9264630 | 0.76 | LTA4H (0.48) | ALDH1A1MAPK1TDP1LMNAPDE4A | |
| SCHEMBL3007010 | 0.76 | LTA4H (0.48) | ALDH1A1MAPK1TDP1LMNAPDE4A | |
| SCHEMBL27685834 | 0.76 | LTA4H (0.48) | ALDH1A1MAPK1TDP1LMNAPDE4A | |
| SCHEMBL30062021 | 0.75 | ALDH1A1 (0.38) | ALDH1A1TDP1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL2266382 | 0.73 | ALDH1A1 (0.69) | ALDH1A1MAPK1TDP1LMNASLC1A3 | |
| SCHEMBL28738424 | 0.73 | TDP1 (0.43) | ALDH1A1TDP1LMNASLC1A3SLC1A2 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114174277-B | 2, 6-Trimethyl-4, 5-dihydro-3H-oxaheptacyclic as aromatic component | 巴斯夫欧洲公司 | 2024-06-04 | — | — | CN | disclosed |
| CN-118103021-A | Esters of 5-methylhex-2-enol and use thereof as fragrance chemicals | 巴斯夫欧洲公司 | 2024-05-28 | — | — | CN | disclosed |
| CN-117813368-A | Use of substituted cyclopentenones and cyclopentanones as fragrance ingredients | 巴斯夫欧洲公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-117795087-A | Novel production of aromatic compounds with violet subunit ethane synthase | 巴斯夫欧洲公司 | 2024-03-29 | — | — | CN | disclosed |
| CN-117616108-A | Use of 2,3, 6-trimethyl-2-cyclohexen-1-one as a fragrance ingredient | 巴斯夫欧洲公司 | 2024-02-27 | — | — | CN | disclosed |
| CN-117396586-A | 1, 4-butanediol mono-or diesters as fragrance chemicals | 巴斯夫欧洲公司 | 2024-01-12 | — | — | CN | disclosed |
| CN-117120407-A | Aryl/alkenyl pentenal derivatives as fragrance chemicals | 巴斯夫欧洲公司 | 2023-11-24 | — | — | CN | disclosed |
| CN-117120406-A | Dialkyl pentene ether and dialkyl pentadiene ether derivatives as fragrances | 巴斯夫欧洲公司 | 2023-11-24 | — | — | CN | disclosed |
| CN-117062899-A | 2- (2- (3-methylbut-2-en-1-yl) phenyl) propanal and mixtures thereof as fragrance ingredients | 巴斯夫欧洲公司 | 2023-11-14 | — | — | CN | disclosed |
| CN-116249687-A | Bicyclic aromatic chemicals | 巴斯夫欧洲公司 | 2023-06-09 | — | — | CN | disclosed |