Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 11/20 | 0.58 |
| ▸ | TLR8 | Q9NR97 | 7/20 | 0.53 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | DRD1 | P21728 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL18605999 | 0.91 | KCNH2 (0.63) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL13975800 | 0.91 | KCNH2 (0.63) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL30608946 | 0.84 | TLR8 (0.67) | KCNH2TLR8TLR7 | |
| SCHEMBL18109656 | 0.84 | TLR8 (0.67) | KCNH2TLR8TLR7 | |
| SCHEMBL18109655 | 0.84 | TLR8 (0.67) | KCNH2TLR8TLR7 | |
| SCHEMBL13975711 | 0.81 | KCNH2 (0.85) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL13975710 | 0.81 | KCNH2 (0.85) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL19723066 | 0.81 | KCNH2 (0.85) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL19723139 | 0.81 | KCNH2 (0.65) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL13975548 | 0.79 | CYP2D6 (0.61) | KCNH2TLR8TLR7CYP2D6DRD1 |
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-2709989-B1 | QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS AND FURTHER DISEASES | JANSSEN SCIENCES IRELAND UC (IE) | 2017-12-20 | — | — | EP | disclosed |