Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC10A1 | Q14973 | 17/20 | 0.42 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28898134 | 0.93 | SLC10A1 (0.42) | SLC10A1GRM4LRRK2 | |
| SCHEMBL28898130 | 0.92 | SLC10A1 (0.41) | SLC10A1GRM4LRRK2 | |
| SCHEMBL28898138 | 0.88 | GRM4 (0.39) | SLC10A1GRM4LRRK2 | |
| SCHEMBL28898148 | 0.84 | GRM4 (0.39) | SLC10A1GRM4LRRK2 | |
| SCHEMBL30361258 | 0.84 | SLC10A1 (0.49) | SLC10A1GRM4LRRK2 | |
| SCHEMBL28492819 | 0.84 | SLC10A1 (0.49) | SLC10A1GRM4LRRK2 | |
| SCHEMBL21428046 | 0.84 | SLC10A1 (0.49) | SLC10A1GRM4LRRK2 | |
| SCHEMBL28898152 | 0.82 | GRM4 (0.40) | SLC10A1GRM4LRRK2 | |
| SCHEMBL28898147 | 0.82 | TSHR (0.43) | SLC10A1 | |
| SCHEMBL28898142 | 0.82 | TSHR (0.44) | SLC10A1GRM4LRRK2 |
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-111868026-B | Capsid protein assembly inhibitor containing N-heterocyclic five-membered ring, pharmaceutical composition and application thereof | 正大天晴药业集团股份有限公司 | 2022-11-25 | — | — | CN | disclosed |