Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10965396 | 0.77 | — | — | |
| SCHEMBL9273653 | 0.71 | FFAR3 (0.40) | CYP3A4CYP2C19 | |
| SCHEMBL13857420 | 0.69 | HCAR2 (0.34) | CYP3A4ALDH1A1CYP2C9TSHR | |
| SCHEMBL15116873 | 0.69 | — | — | |
| SCHEMBL14234405 | 0.69 | — | — | |
| SCHEMBL11283447 | 0.67 | — | — | |
| SCHEMBL5130904 | 0.67 | FFAR3 (0.35) | ALDH1A1 | |
| SCHEMBL11219960 | 0.67 | — | — | |
| Lithium Ion SCHEMBL5130900 | 0.66 | — | — | |
| SCHEMBL24780998 | 0.65 | TSHR (0.40) | CYP3A4CYP2C19ALDH1A1CYP2C9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0413793-A1 | NEW CONCENTRATED AQUEOUS EMULSIONS, PROCESS FOR PREPARING THEM AND THEIR USE IN THE FIELD OF PESTICIDES. | ROUSSEL UCLAF (FR) | 1991-02-27 | — | — | EP | disclosed |