Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.56 |
| ▸ | THRB | P10828 | 2/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | S100B | P04271 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | EIF2AK4 | Q9P2K8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10700607 | 0.83 | TDP1 (0.46) | ALDH1A1CYP3A4TDP1THRBALOX15 | |
| Hydrochloric Acid SCHEMBL1752687 | 0.82 | TDP1 (0.45) | ALDH1A1CYP3A4TDP1THRBALOX15 | |
| SCHEMBL11511767 | 0.78 | CYP3A4 (0.77) | ALDH1A1CYP3A4TDP1THRBALOX15 | |
| SCHEMBL29965600 | 0.77 | SMN1; SMN2 (0.52) | ALDH1A1CYP3A4TDP1THRBALOX15 | |
| SCHEMBL21262587 | 0.77 | SMN1; SMN2 (0.52) | ALDH1A1CYP3A4TDP1THRBALOX15 | |
| SCHEMBL24436849 | 0.76 | TDP1 (0.57) | ALDH1A1CYP3A4TDP1THRBALOX15 | |
| SCHEMBL10826314 | 0.76 | CYP3A4 (0.57) | ALDH1A1CYP3A4TDP1THRBALOX15 | |
| Hydrochloric Acid SCHEMBL11439401 | 0.74 | CYP3A4 (0.55) | ALDH1A1CYP3A4TDP1THRBALOX15 | |
| SCHEMBL29709 | 0.74 | CYP3A4 (0.71) | ALDH1A1CYP3A4TDP1THRBALOX15 | |
| Hydrochloric Acid SCHEMBL11092761 | 0.74 | CYP3A4 (0.55) | ALDH1A1CYP3A4TDP1THRBALOX15 |
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-108348448-B | Oil-in-water organopolysiloxane emulsion, method for producing same, cosmetic raw material, and cosmetic | 陶氏东丽株式会社 | 2021-08-20 | — | — | CN | disclosed |