Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 19/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | IL17A | Q16552 | 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 | |
|---|---|---|---|---|
| SCHEMBL21732292 | 0.91 | RORC (0.39) | SCN9ARORCCYP2D6IL17A | |
| SCHEMBL21732205 | 0.83 | RORC (0.40) | RORCCYP2D6IL17A | |
| SCHEMBL21732213 | 0.83 | RORC (0.39) | RORCCYP2D6IL17A | |
| SCHEMBL21732264 | 0.82 | RORC (0.43) | RORCCYP2D6IL17A | |
| SCHEMBL21732207 | 0.81 | RORC (0.41) | RORCCYP2D6IL17A | |
| SCHEMBL21732187 | 0.81 | RORC (0.40) | RORCCYP2D6IL17A | |
| SCHEMBL21732253 | 0.79 | RORC (0.47) | RORCCYP2D6KCNH2IL17A | |
| SCHEMBL21732180 | 0.79 | RORC (0.47) | SCN9ARORC | |
| SCHEMBL21732117 | 0.79 | RORC (0.46) | RORCCYP2D6IL17A | |
| SCHEMBL21732118 | 0.77 | RORC (0.51) | RORCCYP2D6KCNH2IL17A |
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-2020035557-A1 | NOVEL HETEROAROMATIC MODULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA | LEO PHARMA A/S (DK) | 2020-02-20 | — | — | WO | disclosed |