Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 4/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14775950 | 1.00 | RORC (0.33) | RORCCYP2C8CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL909084 | 0.81 | PDK1 (0.36) | RORCCYP2C8CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL909762 | 0.81 | PDK1 (0.36) | RORCCYP2C8CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL537517 | 0.79 | RORC (0.35) | RORCCYP2C8CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL14775727 | 0.77 | CNR2 (0.44) | — | |
| SCHEMBL1208500 | 0.76 | PDK1 (0.45) | RORC | |
| SCHEMBL2054543 | 0.68 | CNR2 (0.32) | RORCCYP2C8CYP2C9 | |
| SCHEMBL1211517 | 0.68 | CNR2 (0.32) | RORCCYP2C8CYP2C9 | |
| SCHEMBL1208105 | 0.68 | CNR2 (0.32) | RORCCYP2C8CYP2C9 | |
| SCHEMBL1107075 | 0.68 | PDK1 (0.40) | — |
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-2240467-B1 | AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME | EVOTEC AG (DE) | 2013-03-20 | — | — | EP | claimed |