Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.60 |
| ▸ | CDK2 | P24941 | 2/20 | 0.51 |
| ▸ | CAMK2B | Q13554 | 2/20 | 0.51 |
| ▸ | CAMK2G | Q13555 | 2/20 | 0.51 |
| ▸ | CAMK2D | Q13557 | 2/20 | 0.51 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.51 |
| ▸ | CDK4 | P11802 | 1/20 | 0.51 |
| ▸ | CCND1 | P24385 | 1/20 | 0.51 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.51 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.51 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.49 |
| ▸ | GRIN3B | O60391 | 3/20 | 0.49 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.49 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.49 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.49 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.49 |
| ▸ | GRIN3A | Q8TCU5 | 3/20 | 0.49 |
| ▸ | PTGES | O14684 | 1/20 | 0.48 |
| ▸ | CDC25A | P30304 | 1/20 | 0.47 |
| ▸ | CDC25C | P30307 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL20227584 | 0.83 | PARP1 (0.57) | PARP1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL30466767 | 0.83 | PARP1 (0.57) | PARP1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL25835543 | 0.77 | CDC25A (0.56) | PARP1CDK2CAMK2BCAMK2GCAMK2D | |
| SCHEMBL8874832 | 0.77 | PARP1 (0.75) | PARP1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL9384092 | 0.75 | PARP1 (1.00) | PARP1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL14566746 | 0.75 | PARP1 (0.85) | PARP1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL27968034 | 0.73 | PARP1 (0.58) | PARP1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL7250753 | 0.72 | KDM4E (0.52) | PARP1CDK2CAMK2BCAMK2GCAMK2D | |
| SCHEMBL7252401 | 0.72 | ROCK2 (0.52) | PARP1CDK2CAMK2BCAMK2GCAMK2D | |
| SCHEMBL7254515 | 0.72 | PARP1 (0.57) | PARP1CDK2CAMK2BCAMK2GCAMK2D |
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-2023110742-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2023-06-22 | — | — | WO | disclosed |