Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 12/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 9/20 | 0.43 |
| ▸ | PARP6 | Q2NL67 | 6/20 | 0.43 |
| ▸ | PARP3 | Q9Y6F1 | 5/20 | 0.43 |
| ▸ | TNKS | O95271 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 4/20 | 0.32 |
| ▸ | RBP4 | P02753 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29026157 | 0.90 | PARP1 (0.42) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL30427906 | 0.85 | PARP1 (0.40) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL30428081 | 0.85 | PARP1 (0.44) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL30212738 | 0.82 | PARP1 (0.51) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL29026151 | 0.75 | PARP1 (0.42) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL22912769 | 0.75 | BACE1 (0.48) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL30982267 | 0.75 | BACE1 (0.48) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL22912770 | 0.74 | PARP1 (0.52) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL29397384 | 0.74 | PARP1 (0.52) | PARP1PARP2PARP6PARP3TNKS | |
| Hydrochloric Acid SCHEMBL30663255 | 0.73 | PARP1 (0.51) | PARP1PARP2PARP6PARP3TNKS |
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-116348115-A | Combination of antibody-drug conjugate and PARP1 selective inhibitor | 阿斯利康(英国)有限公司 | 2023-06-27 | — | — | CN | disclosed |