Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 20/20 | 1.00 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.53 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2267502 | 1.00 | PARP1 (1.00) | PARP1PARP2PARP3 | |
| SCHEMBL30157322 | 0.90 | PARP1 (0.81) | PARP1PARP2PARP3 | |
| SCHEMBL2265294 | 0.90 | PARP1 (0.81) | PARP1PARP2PARP3 | |
| SCHEMBL4793123 | 0.86 | PARP1 (1.00) | PARP1PARP2PARP3 | |
| Hydrochloric Acid SCHEMBL2265760 | 0.85 | PARP1 (0.98) | PARP1PARP2PARP3 | |
| Trifluoroacetic Acid SCHEMBL2263566 | 0.81 | PARP1 (0.88) | PARP1PARP2PARP3 | |
| Trifluoroacetic Acid SCHEMBL30875667 | 0.79 | PARP1 (0.65) | PARP1PARP2PARP3 | |
| Trifluoroacetic Acid SCHEMBL2267844 | 0.79 | PARP1 (0.65) | PARP1PARP2PARP3 | |
| SCHEMBL2262894 | 0.79 | PARP1 (1.00) | PARP1PARP2PARP3 | |
| SCHEMBL30875648 | 0.79 | PARP1 (1.00) | PARP1PARP2PARP3 |
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-113288892-B | Use of poly ADP-ribose polymerase inhibitors against coronaviruses | 甫康（上海）健康科技有限责任公司 | 2024-04-26 | — | — | CN | disclosed |