Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.57 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.48 |
| ▸ | PPARG | P37231 | 2/20 | 0.48 |
| ▸ | PPARD | Q03181 | 2/20 | 0.48 |
| ▸ | PPARA | Q07869 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.48 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.48 |
| ▸ | TLR2 | O60603 | 1/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28890656 | 0.85 | FFAR4 (0.47) | CES2MEN1KMT2AGPR84 | |
| SCHEMBL28140535 | 0.81 | CES2 (0.67) | CES2CES1MEN1KMT2AGPR84 | |
| SCHEMBL10401053 | 0.81 | CES2 (0.55) | CES2CES1MEN1FAAHMAPK1 | |
| SCHEMBL11036679 | 0.81 | CES2 (0.55) | CES2CES1MEN1FAAHMAPK1 | |
| SCHEMBL28771948 | 0.81 | CES2 (0.41) | CES2CES1MEN1FAAHMAPK1 | |
| SCHEMBL13954173 | 0.79 | CES2 (0.53) | CES2CES1MEN1FAAHMAPK1 | |
| Hydrogen Sulfide SCHEMBL28156949 | 0.79 | CES2 (0.53) | CES2CES1MEN1FAAHMAPK1 | |
| SCHEMBL13184671 | 0.79 | CES2 (0.53) | CES2CES1MEN1FAAHMAPK1 | |
| SCHEMBL10590670 | 0.79 | CES2 (0.62) | CES2CES1GPR84PPARGPPARD | |
| SCHEMBL28556942 | 0.78 | CES2 (0.52) | CES2CES1MEN1FAAHMAPK1 |
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-100427078-C | Decanoyl acetaldehyde compound and its medicinal composition | SHENZHEN HAIWANG PHARMACEUTICA (CN) | 2008-10-22 | — | — | CN | disclosed |
| CN-1813691-A | Decanoyl acetaldehyde compound and its medicinal composition | SHENZHEN HAIWANG PHARMACEUTICA (CN) | 2006-08-09 | — | — | CN | disclosed |