Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.71 |
| ▸ | LTA4H | P09960 | 3/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.62 |
| ▸ | RNF4 | P78317 | 1/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.58 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.52 |
| ▸ | MMP2 | P08253 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL22069565 | 0.92 | RECQL (0.75) | RECQLLTA4HKDM4ERNF4HDAC1 | |
| SCHEMBL5659377 | 0.86 | LTA4H (0.63) | RECQLLTA4HKDM4ERNF4HDAC1 | |
| SCHEMBL5659423 | 0.85 | LTA4H (0.65) | RECQLLTA4HKDM4ERNF4HDAC1 | |
| SCHEMBL22069671 | 0.85 | GAA (0.73) | RECQLLTA4HKDM4ERNF4HDAC1 | |
| SCHEMBL5659737 | 0.85 | LTA4H (0.62) | RECQLLTA4HKDM4ERNF4HDAC1 | |
| SCHEMBL5661814 | 0.85 | LTA4H (0.62) | RECQLLTA4HKDM4ERNF4HDAC1 | |
| SCHEMBL5659647 | 0.85 | LTA4H (0.62) | RECQLLTA4HKDM4ERNF4HDAC1 | |
| SCHEMBL5661438 | 0.84 | KDM4E (0.70) | RECQLLTA4HKDM4ERNF4HDAC1 | |
| SCHEMBL5661523 | 0.84 | LTA4H (0.64) | RECQLLTA4HKDM4ERNF4HDAC1 | |
| SCHEMBL22069657 | 0.83 | RECQL (1.00) | RECQLLTA4HKDM4ERNF4HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3666769-A1 | NOVEL CASPASE INHIBITORS | RIJKSUNIVERSITEIT GRONINGEN (NL) | 2020-06-17 | — | — | EP | disclosed |
| EP-3666769-A1 | NOVEL CASPASE INHIBITORS | RIJKSUNIVERSITEIT GRONINGEN (NL) | 2020-06-17 | — | — | EP | disclosed |