Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.32 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.32 |
| ▸ | SPR | P35270 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL24858683 | 0.82 | MAPK1 (0.37) | NPC1 | |
| SCHEMBL24858305 | 0.78 | CCNB2 (0.31) | — | |
| SCHEMBL31195590 | 0.73 | SPR (0.43) | SPR | |
| SCHEMBL34460387 | 0.73 | SPR (0.43) | SPR | |
| SCHEMBL27594193 | 0.72 | RXFP1 (0.53) | NPC1RXFP1KCNQ3KCNQ2EPHX2 | |
| SCHEMBL24858674 | 0.71 | CYP4F2 (0.39) | NPC1 | |
| SCHEMBL5046191 | 0.66 | NPC1 (0.66) | NPC1RXFP1KCNQ3KCNQ2 | |
| SCHEMBL5042391 | 0.64 | ALDH1A1 (0.54) | NPC1RXFP1EPHX2 | |
| SCHEMBL23559727 | 0.64 | KDM4E (0.43) | — | |
| SCHEMBL25015127 | 0.63 | KDM4E (0.41) | NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023272410-A1 | ERα RECEPTOR COVALENT BINDING ANTAGONIST | 北京盛诺基医药科技股份有限公司 | 2023-01-05 | — | — | WO | disclosed |