Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 8/20 | 0.50 |
| ▸ | PDE3A | Q14432 | 8/20 | 0.50 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 8/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22307699 | 1.00 | PDE3B (0.50) | PDE3BPDE3ASLC10A1KCNK3GAA | |
| SCHEMBL22307724 | 1.00 | PDE3B (0.50) | PDE3BPDE3ASLC10A1KCNK3GAA | |
| SCHEMBL28630776 | 0.87 | SLC10A1 (0.44) | SLC10A1KCNK3ALDH1A1 | |
| SCHEMBL28630773 | 0.87 | SLC10A1 (0.44) | SLC10A1KCNK3ALDH1A1 | |
| SCHEMBL22308115 | 0.85 | SLC10A1 (0.48) | SLC10A1KCNK3 | |
| SCHEMBL22308116 | 0.85 | SLC10A1 (0.48) | SLC10A1KCNK3 | |
| SCHEMBL28631357 | 0.85 | SLC10A1 (0.48) | SLC10A1KCNK3 | |
| SCHEMBL28638198 | 0.83 | SLC10A1 (0.46) | SLC10A1KCNK3 | |
| SCHEMBL28638202 | 0.83 | SLC10A1 (0.46) | SLC10A1KCNK3 | |
| SCHEMBL22308111 | 0.80 | PDE3B (0.58) | PDE3BPDE3AKCNK3GAAMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113365999-B | Capsid protein assembly inhibitors containing pyrroloheterocycles | 正大天晴药业集团股份有限公司 | 2023-04-14 | — | — | CN | disclosed |
| CN-113365999-A | Capsid protein assembly inhibitors containing pyrroloheterocycles | 正大天晴药业集团股份有限公司 | 2021-09-07 | — | — | CN | disclosed |