Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 3/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL1720 | 0.88 | SIGMAR1 (0.48) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL7163153 | 0.82 | MAOA (0.52) | SIGMAR1MAPTRXFP1HTR3ATDP1 | |
| SCHEMBL9671296 | 0.80 | SIGMAR1 (0.52) | SIGMAR1MAPTRXFP1L3MBTL1MAOA | |
| SCHEMBL9428184 | 0.80 | SIGMAR1 (0.52) | SIGMAR1MAPTRXFP1L3MBTL1MAOA | |
| SCHEMBL15530118 | 0.80 | SIGMAR1 (0.52) | SIGMAR1MAPTRXFP1L3MBTL1MAOA | |
| SCHEMBL7166792 | 0.80 | SIGMAR1 (0.52) | SIGMAR1MAPTRXFP1L3MBTL1MAOA | |
| Formic Acid SCHEMBL28229876 | 0.77 | FFAR1 (0.56) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| Formic Acid SCHEMBL30493587 | 0.76 | ADH1B (0.39) | TDP1EPHX1 | |
| Hydrocinnamyl Alcohol SCHEMBL27655547 | 0.76 | TDP1 (0.56) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL129338 | 0.75 | TDP1 (0.52) | SMN1; SMN2SIGMAR1TDP1L3MBTL1MAOA |
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-117466942-A | Chiral secondary phosphine oxide compound, chiral quinazolinone/pyrimidinone ring derivative based on chiral secondary phosphine oxide compound and application of chiral quinazolinone/pyrimidinone ring derivative | 中山大学 | 2024-01-30 | — | — | CN | disclosed |