Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 13/20 | 0.46 |
| ▸ | TLR7 | Q9NYK1 | 13/20 | 0.46 |
| ▸ | TLR8 | Q9NR97 | 12/20 | 0.46 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | SORD | Q00796 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24120216 | 1.00 | TLR9 (0.46) | TLR9TLR7TLR8CCNT1CCNA2 | |
| SCHEMBL24120538 | 0.93 | TLR9 (0.44) | TLR9TLR7TLR8 | |
| SCHEMBL21815335 | 0.93 | TLR9 (0.44) | TLR9TLR7TLR8 | |
| SCHEMBL24120227 | 0.92 | TLR9 (0.48) | TLR9TLR7TLR8HRH1HRH3 | |
| SCHEMBL25700218 | 0.92 | TLR9 (0.48) | TLR9TLR7TLR8HRH1HRH3 | |
| SCHEMBL25417310 | 0.92 | TLR9 (0.48) | TLR9TLR7TLR8HRH1HRH3 | |
| SCHEMBL24120228 | 0.92 | TLR9 (0.47) | TLR9TLR7TLR8HRH1HRH3 | |
| SCHEMBL25699773 | 0.92 | TLR9 (0.51) | TLR9TLR7TLR8ALDH1A1HRH1 | |
| SCHEMBL24120542 | 0.92 | TLR9 (0.51) | TLR9TLR7TLR8ALDH1A1HRH1 | |
| SCHEMBL21815378 | 0.91 | TLR9 (0.43) | TLR9TLR7TLR8ALDH1A1 |
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-3856737-B1 | HETEROCYCLYL COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE | HOFFMANN LA ROCHE (CH) | 2023-05-17 | — | — | EP | disclosed |