Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.51 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.50 |
| ▸ | GRIN3B | O60391 | 3/20 | 0.50 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.50 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.50 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.50 |
| ▸ | GRIN3A | Q8TCU5 | 3/20 | 0.50 |
| ▸ | CDC25A | P30304 | 1/20 | 0.48 |
| ▸ | CDC25C | P30307 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | DAO | P14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL14355038 | 0.92 | PARP1 (0.70) | PARP1TP53SMN1; SMN2LMNACHEK1 | |
| SCHEMBL14566746 | 0.84 | PARP1 (0.85) | PARP1TP53SMN1; SMN2LMNACHEK1 | |
| SCHEMBL6009586 | 0.82 | KIF11 (0.62) | PARP1TP53SMN1; SMN2LMNACHEK1 | |
| SCHEMBL20792931 | 0.80 | PARP1 (0.56) | PARP1LMNACHEK1DAO | |
| SCHEMBL9384092 | 0.80 | PARP1 (1.00) | PARP1TP53SMN1; SMN2LMNACHEK1 | |
| SCHEMBL30610337 | 0.79 | PARP1 (0.66) | PARP1TP53SMN1; SMN2LMNACA9 | |
| SCHEMBL14355037 | 0.78 | PARP1 (0.51) | PARP1TP53SMN1; SMN2LMNACHEK1 | |
| SCHEMBL8874832 | 0.78 | PARP1 (0.75) | PARP1TP53SMN1; SMN2LMNACHEK1 | |
| SCHEMBL26560322 | 0.77 | KIF11 (0.67) | PARP1LMNA | |
| SCHEMBL20227580 | 0.77 | PARP1 (0.67) | PARP1LMNACHEK1GRIN2DGRIN3B |
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 2 patents. 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 |
| CN-102977017-A | Method for catalytically preparing 6(5H)-phenanthridine ketone by copper component | UNIV HUNAN | 2013-03-20 | — | — | CN | disclosed |