Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8249898 | 0.75 | LMNA (0.34) | LMNAHTTKMT2AL3MBTL1 | |
| SCHEMBL13068448 | 0.70 | — | — | |
| SCHEMBL11656888 | 0.67 | — | — | |
| SCHEMBL15024769 | 0.67 | ALDH1A1 (0.38) | LMNAHTT | |
| SCHEMBL9735549 | 0.67 | GAA (0.32) | — | |
| SCHEMBL31408830 | 0.62 | KDM4E (0.32) | LMNA | |
| SCHEMBL10977946 | 0.61 | LMNA (0.46) | LMNAHTTKMT2AL3MBTL1 | |
| SCHEMBL4429911 | 0.59 | ALDH1A1 (0.39) | LMNAHTTKMT2AL3MBTL1 | |
| SCHEMBL31408916 | 0.59 | — | — | |
| SCHEMBL7016950 | 0.58 | — | — |
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-1907382-B1 | NITROCATECHOL DERIVATIVES AS COMT INHIBITORS | BIAL PORTELA & CA SA (PT) | 2015-05-27 | — | — | EP | disclosed |