Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.30 |
| ▸ | CCR5 | P51681 | 1/20 | 0.30 |
| ▸ | CCR8 | P51685 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28892165 | 1.00 | NPC1 (0.33) | NPC1HSP90AA1L3MBTL1CCR1CCR5 | |
| SCHEMBL19104618 | 0.84 | CCR1 (0.33) | NPC1HSP90AA1L3MBTL1CCR1CCR5 | |
| SCHEMBL9976522 | 0.74 | NPC1 (0.39) | NPC1HSP90AA1L3MBTL1CCR1CCR5 | |
| SCHEMBL28892158 | 0.73 | L3MBTL1 (0.55) | NPC1HSP90AA1L3MBTL1CCR1CCR5 | |
| SCHEMBL10293912 | 0.73 | HSP90AA1 (0.46) | NPC1HSP90AA1L3MBTL1CCR1CCR5 | |
| SCHEMBL13271277 | 0.71 | COMT (0.37) | HSP90AA1L3MBTL1 | |
| SCHEMBL11790193 | 0.70 | HSP90AA1 (0.43) | NPC1HSP90AA1L3MBTL1CCR1CCR5 | |
| SCHEMBL21297747 | 0.70 | HSP90AA1 (0.43) | NPC1HSP90AA1L3MBTL1CCR1CCR5 | |
| SCHEMBL28193508 | 0.68 | ADRA2A (0.45) | NPC1HSP90AA1L3MBTL1CCR1CCR5 | |
| SCHEMBL14824894 | 0.67 | CCR1 (0.58) | NPC1HSP90AA1L3MBTL1CCR1CCR5 |
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-115232144-B | Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |