Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25A | P30304 | 1/20 | 0.56 |
| ▸ | CDC25C | P30307 | 1/20 | 0.56 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.50 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.49 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.49 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.49 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.49 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.49 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.49 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.49 |
| ▸ | PTGES | O14684 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.48 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
| ▸ | CSF1R | P07333 | 1/20 | 0.48 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.48 |
| ▸ | CDK2 | P24941 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL22866497 | 0.83 | PARP1 (0.57) | CDC25ACDC25CCHEK1GRIN2DGRIN3B | |
| SCHEMBL30891741 | 0.83 | PARP1 (0.57) | CDC25ACDC25CCHEK1GRIN2DGRIN3B | |
| SCHEMBL29204435 | 0.80 | PARP1 (0.64) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL25834658 | 0.77 | PARP1 (0.60) | CDC25ACDC25CCHEK1GRIN2DGRIN3B | |
| SCHEMBL14355028 | 0.75 | PARP1 (0.67) | CDC25ACDC25CCHEK1GRIN2DGRIN3B | |
| SCHEMBL20227580 | 0.75 | PARP1 (0.67) | CDC25ACDC25CCHEK1GRIN2DGRIN3B | |
| SCHEMBL14355035 | 0.75 | PARP1 (0.62) | CDC25ACDC25CGRIN2DGRIN3BGRIN1 | |
| SCHEMBL7250753 | 0.75 | KDM4E (0.52) | CHEK1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL7252401 | 0.75 | ROCK2 (0.52) | CDC25ACDC25CCHEK1GRIN2DGRIN3B | |
| SCHEMBL7254515 | 0.75 | PARP1 (0.57) | CHEK1GRIN2DGRIN3BGRIN1GRIN2A |
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 |