Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 17/20 | 0.62 |
| ▸ | TNKS | O95271 | 1/20 | 0.49 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.48 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10039749 | 0.84 | PARP1 (0.68) | PARP1 | |
| SCHEMBL10039736 | 0.83 | PARP1 (0.69) | PARP1 | |
| SCHEMBL10039888 | 0.83 | PARP1 (0.67) | PARP1 | |
| SCHEMBL10039734 | 0.83 | PARP1 (0.62) | PARP1 | |
| SCHEMBL10039728 | 0.82 | PARP1 (0.66) | PARP1 | |
| SCHEMBL10054569 | 0.82 | PARP1 (0.70) | PARP1TNKSTNKS2HSP90AA1HSP90AB1 | |
| SCHEMBL10039887 | 0.82 | PARP1 (0.69) | PARP1TNKSTNKS2 | |
| SCHEMBL10039874 | 0.82 | PARP1 (0.65) | PARP1 | |
| SCHEMBL10039712 | 0.81 | PARP1 (0.66) | PARP1 | |
| SCHEMBL10039719 | 0.81 | PARP1 (0.62) | PARP1 |
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-2012019430-A1 | PHTHALAZINONE DERIVATIVE, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-02-16 | — | — | WO | disclosed |