Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 8/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NUDT1 | P36639 | 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 | |
|---|---|---|---|---|
| SCHEMBL19986533 | 0.90 | NUDT1 (0.33) | NUDT1 | |
| SCHEMBL19986571 | 0.77 | ADH1B (0.34) | P2RX7MAPT | |
| SCHEMBL14746054 | 0.67 | ADH1B (0.41) | — | |
| SCHEMBL23981950 | 0.66 | MAPT (0.42) | P2RX7MAPT | |
| SCHEMBL19986532 | 0.65 | ADH1B (0.39) | — | |
| SCHEMBL19986466 | 0.64 | L3MBTL1 (0.36) | — | |
| SCHEMBL19986511 | 0.63 | ADH1B (0.38) | — | |
| SCHEMBL19986538 | 0.62 | KMT2A (0.60) | MAPT | |
| SCHEMBL19986541 | 0.61 | HAO1 (0.33) | MAPT | |
| SCHEMBL270048 | 0.61 | — | — |
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-2018050110-A1 | NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-03-22 | — | — | WO | disclosed |