Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 15/20 | 0.54 |
| ▸ | CDK4 | P11802 | 3/20 | 0.49 |
| ▸ | CCND1 | P24385 | 3/20 | 0.49 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.49 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.49 |
| ▸ | CDK2 | P24941 | 2/20 | 0.49 |
| ▸ | CAMK2B | Q13554 | 2/20 | 0.49 |
| ▸ | CAMK2G | Q13555 | 2/20 | 0.49 |
| ▸ | CAMK2D | Q13557 | 2/20 | 0.49 |
| ▸ | CAMK2A | Q9UQM7 | 2/20 | 0.49 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.45 |
| ▸ | WEE1 | P30291 | 2/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12845991 | 0.81 | PARP1 (0.52) | PARP1CHEK1WEE1PARP2 | |
| SCHEMBL14980877 | 0.75 | PARP1 (0.59) | PARP1CDK4CCND1CCNE2CCNE1 | |
| SCHEMBL4910767 | 0.73 | CHEK1 (0.50) | PARP1CDK4CCND1CCNE2CCNE1 | |
| SCHEMBL8554694 | 0.72 | CHEK1 (0.49) | PARP1CDK4CCND1CCNE2CCNE1 | |
| SCHEMBL8558051 | 0.72 | CHEK1 (0.49) | PARP1CDK4CCND1CCNE2CCNE1 | |
| SCHEMBL8559090 | 0.72 | CHEK1 (0.49) | PARP1CDK4CCND1CCNE2CCNE1 | |
| SCHEMBL12846165 | 0.71 | PARP1 (0.66) | PARP1CDK4CCND1CHEK1 | |
| Hydrochloric Acid SCHEMBL7381819 | 0.69 | CYP2A13 (0.41) | CDK4CCND1CCNE2CCNE1CDK2 | |
| SCHEMBL14980870 | 0.69 | PARP1 (1.00) | PARP1CDK4CCND1CCNE2CCNE1 | |
| SCHEMBL3361947 | 0.68 | PARP1 (0.62) | PARP1CDK4CCND1CHEK1PARP2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2066324-B1 | CYCLOALKANOPYROLOCARBAZOLE DERIVATIVES AND THE USE THEREOF AS PARP, VEGFR2 AND MLK3 INHIBITORS | CEPHALON INC (US) | 2013-05-29 | — | — | EP | disclosed |