Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 20/20 | 0.67 |
| ▸ | PARP2 | Q9UGN5 | 14/20 | 0.67 |
| ▸ | PARP3 | Q9Y6F1 | 14/20 | 0.67 |
| ▸ | TNKS | O95271 | 1/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.55 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.55 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.55 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.55 |
| ▸ | PARP12 | Q9H0J9 | 1/20 | 0.55 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.55 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.55 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2264004 | 0.94 | PARP1 (0.60) | PARP1PARP2PARP3TNKSCHRM2 | |
| SCHEMBL30875630 | 0.94 | PARP1 (0.69) | PARP1PARP2PARP3TNKSCHRM2 | |
| SCHEMBL2265268 | 0.94 | PARP1 (0.66) | PARP1PARP2PARP3TNKSCHRM2 | |
| Trifluoroacetic Acid SCHEMBL2266647 | 0.90 | PARP1 (0.60) | PARP1PARP2PARP3TNKSCHRM2 | |
| Trifluoroacetic Acid SCHEMBL2265732 | 0.89 | PARP1 (0.62) | PARP1PARP2PARP3TNKSCHRM2 | |
| SCHEMBL30875669 | 0.85 | PARP1 (0.74) | PARP1PARP2PARP3 | |
| Trifluoroacetic Acid SCHEMBL2263201 | 0.85 | PARP1 (0.63) | PARP1PARP2PARP3TNKSCHRM2 | |
| SCHEMBL30875672 | 0.84 | PARP1 (0.75) | PARP1PARP2PARP3 | |
| SCHEMBL30875634 | 0.83 | PARP1 (0.73) | PARP1PARP2PARP3TNKSCHRM2 | |
| Trifluoroacetic Acid SCHEMBL2261793 | 0.82 | PARP1 (0.64) | PARP1PARP2PARP3TNKSCHRM2 |
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 |