Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.31 |
| ▸ | HRH1 | P35367 | 3/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24095632 | 0.77 | PDE5A (0.31) | — | |
| SCHEMBL24095597 | 0.66 | P2RX7 (0.33) | — | |
| SCHEMBL24095629 | 0.66 | P2RX3 (0.34) | KCNH2 | |
| SCHEMBL20432067 | 0.64 | HSD11B1 (0.40) | — | |
| SCHEMBL24095642 | 0.62 | NPSR1 (0.39) | KCNH2 | |
| SCHEMBL18833638 | 0.62 | USP1 (0.38) | — | |
| SCHEMBL24095582 | 0.61 | — | — | |
| SCHEMBL24095631 | 0.60 | P2RX3 (0.37) | — | |
| SCHEMBL10804293 | 0.55 | KCNH2 (0.47) | CYP2D6HRH1KCNH2CHRM1 | |
| SCHEMBL9537190 | 0.54 | PRMT3 (0.44) | CYP2D6HRH1KCNH2CHRM1 |
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-3652176-B1 | SUBSTITUTED XANTHINE DERIVATIVES | BOEHRINGER INGELHEIM INT (DE) | 2021-12-15 | — | — | EP | disclosed |