Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CASP6 | P55212 | 1/20 | 0.46 |
| ▸ | IAPP | P10997 | 2/20 | 0.44 |
| ▸ | SHBG | P04278 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 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 | |
|---|---|---|---|---|
| SCHEMBL10452008 | 0.84 | KDM4E (0.48) | ALDH1A1KDM4ECASP6IAPPSHBG | |
| SCHEMBL25307665 | 0.80 | EGFR (0.43) | ALDH1A1KDM4EIAPPLMNAMAPT | |
| SCHEMBL815527 | 0.80 | GABRA1 (0.44) | ALDH1A1KDM4EIAPPLMNAMAPT | |
| SCHEMBL3415131 | 0.80 | PKM (0.59) | ALDH1A1KDM4EIAPPPKMLMNA | |
| SCHEMBL1674014 | 0.79 | LMNA (0.50) | ALDH1A1KDM4EIAPPPKMLMNA | |
| Acetic Acid SCHEMBL9330895 | 0.78 | KDM4E (0.61) | ALDH1A1KDM4ECASP6SHBGPKM | |
| SCHEMBL1674013 | 0.77 | KDM4E (0.47) | ALDH1A1KDM4EIAPPPKMLMNA | |
| SCHEMBL1405087 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KDM4EIAPPSHBGLMNA | |
| SCHEMBL4452928 | 0.75 | SHBG (0.50) | ALDH1A1KDM4ECASP6SHBGPKM | |
| SCHEMBL16750370 | 0.75 | NPC1 (0.46) | ALDH1A1KDM4EIAPPPKMLMNA |
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-2012080153-A1 | USE OF SUBSTITUTED DIMETHOXYHYDROXYPHENYLALKYL DERIVATIVES AS PRESERVATIVE, PRESERVING METHOD, COMPOUNDS AND COMPOSITION | L'OREAL (FR) | 2012-06-21 | — | — | WO | disclosed |