Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.45 |
| ▸ | CES1 | P23141 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29101988 | 0.82 | CES2 (0.46) | CES2CES1ALDH1A1MAPTALOX15 | |
| SCHEMBL14089105 | 0.82 | ALDH1A1 (0.47) | CES2CES1ALDH1A1MAPTHPGD | |
| SCHEMBL9093296 | 0.80 | LMNA (0.51) | CES2CES1ALDH1A1MAPTTSHR | |
| SCHEMBL2625462 | 0.77 | CES2 (0.54) | CES2CES1ALDH1A1MAPTALOX15 | |
| SCHEMBL8787162 | 0.75 | CES2 (0.52) | CES2CES1ALDH1A1MAPTALOX15 | |
| SCHEMBL9520784 | 0.75 | CES2 (0.52) | CES2CES1ALDH1A1MAPTALOX15 | |
| SCHEMBL1144070 | 0.75 | CES2 (0.52) | CES2CES1ALDH1A1MAPTALOX15 | |
| SCHEMBL14297433 | 0.74 | ALDH1A1 (0.41) | CES2CES1ALDH1A1MAPTALOX15 | |
| SCHEMBL8022083 | 0.74 | CES2 (0.50) | CES2CES1ALDH1A1MAPTALOX15 | |
| SCHEMBL634548 | 0.74 | CES2 (0.50) | CES2CES1ALDH1A1MAPTALOX15 |
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-102603508-B | Preparation method of 1-(4-chlorophenyl)-2-cyclopropyl-1-acetone and intermediate thereof as well as preparation method of intermediate | JIANGSU CHENGYANG CROP TECHNOLOGY CO LTD | 2014-03-12 | — | — | CN | disclosed |