Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | CES2 | O00748 | 2/20 | 0.51 |
| ▸ | CES1 | P23141 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 2/20 | 0.45 |
| ▸ | AR | P10275 | 2/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30121866 | 1.00 | MEN1 (0.56) | MEN1KMT2ACES2CES1L3MBTL1 | |
| SCHEMBL28884953 | 0.91 | CES2 (0.51) | MEN1KMT2ACES2CES1L3MBTL1 | |
| SCHEMBL11526582 | 0.85 | ALDH1A1 (0.55) | MEN1KMT2ACES2CES1L3MBTL1 | |
| SCHEMBL6201780 | 0.84 | LMNA (0.65) | MEN1KMT2ACES2CES1L3MBTL1 | |
| SCHEMBL29110155 | 0.83 | SMN1; SMN2 (0.53) | MEN1KMT2AL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL29110178 | 0.82 | MEN1 (0.56) | MEN1KMT2AL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL29110275 | 0.82 | KMT2A (0.81) | MEN1KMT2AL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL29110180 | 0.82 | KMT2A (0.56) | MEN1KMT2ACES2CES1L3MBTL1 | |
| SCHEMBL30121900 | 0.82 | KMT2A (0.81) | MEN1KMT2AL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL30121859 | 0.82 | KMT2A (0.56) | MEN1KMT2ACES2CES1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115677443-A | Method for constructing 1, 4-diketone compound by olefin 1, 2-dicarbonylation | 中国科学院理化技术研究所 | 2023-02-03 | — | — | CN | disclosed |