Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 20/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 10/20 | 0.51 |
| ▸ | IL17A | Q16552 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21732200 | 0.91 | RORC (0.47) | RORCCYP2D6IL17AKCNH2 | |
| SCHEMBL21732296 | 0.88 | RORC (0.37) | RORCCYP2D6IL17AKCNH2 | |
| SCHEMBL21732284 | 0.86 | RORC (0.49) | RORCCYP2D6IL17A | |
| SCHEMBL21732118 | 0.81 | RORC (0.51) | RORCCYP2D6IL17AKCNH2 | |
| SCHEMBL21732222 | 0.80 | RORC (0.40) | RORCCYP2D6IL17A | |
| SCHEMBL21732235 | 0.79 | RORC (0.50) | RORCCYP2D6IL17AKCNH2 | |
| SCHEMBL21732225 | 0.79 | RORC (0.37) | RORCCYP2D6IL17AKCNH2 | |
| SCHEMBL21732198 | 0.79 | NTRK1 (0.37) | RORCCYP2D6KCNH2 | |
| SCHEMBL21732189 | 0.79 | RORC (0.48) | RORCCYP2D6IL17AKCNH2 | |
| SCHEMBL21732217 | 0.77 | NTRK1 (0.42) | RORCCYP2D6 |
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 |