Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 13/20 | 0.55 |
| ▸ | TLR8 | Q9NR97 | 6/20 | 0.49 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19924220 | 1.00 | KCNH2 (0.55) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL19924219 | 1.00 | KCNH2 (0.55) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL30076107 | 0.88 | KCNH2 (0.73) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL19924248 | 0.88 | KCNH2 (0.73) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL19924250 | 0.88 | KCNH2 (0.73) | KCNH2TLR8TLR7CYP2D6DRD1 | |
| SCHEMBL19924288 | 0.88 | KCNH2 (0.41) | KCNH2TLR8TLR7 | |
| SCHEMBL19924286 | 0.88 | KCNH2 (0.41) | KCNH2TLR8TLR7 | |
| SCHEMBL30076081 | 0.88 | KCNH2 (0.41) | KCNH2TLR8TLR7 | |
| SCHEMBL30608946 | 0.85 | TLR8 (0.67) | KCNH2TLR8TLR7 | |
| SCHEMBL18109655 | 0.85 | TLR8 (0.67) | KCNH2TLR8TLR7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109923106-B | toll-like receptor modulator compounds | 吉利德科学公司 | 2022-09-13 | — | — | CN | disclosed |