Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | LTA4H | P09960 | 7/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| Acetic Acid Butyl Ester SCHEMBL28599658 | 0.82 | ALDH1A1 (0.58) | TDP1TSHRL3MBTL1KMT2AMEN1 | |
| Benzaldehyde SCHEMBL28290719 | 0.82 | ALDH1A1 (0.50) | TDP1TSHRL3MBTL1LTA4HALDH1A1 | |
| SCHEMBL446637 | 0.79 | DGKA (0.59) | TSHRALDH1A1MAPK1MGLL | |
| Benzaldehyde SCHEMBL10781149 | 0.79 | KMT2A (0.53) | LTA4HKMT2AMEN1ALDH1A1KDM4E | |
| Benzaldehyde SCHEMBL28234839 | 0.78 | ALDH1A1 (0.56) | TDP1TSHRL3MBTL1KMT2AMEN1 | |
| Anisaldehyde SCHEMBL28208863 | 0.77 | ALDH1A1 (0.54) | TDP1KMT2AALDH1A1GAALMNA | |
| Benzaldehyde SCHEMBL3860024 | 0.76 | ALDH1A1 (0.64) | TDP1TSHRL3MBTL1KMT2AMEN1 | |
| Benzaldehyde SCHEMBL15272855 | 0.75 | TDP1 (0.54) | TDP1TSHRKMT2AMEN1ALDH1A1 | |
| Octanol SCHEMBL15874528 | 0.75 | TDP1 (0.54) | TDP1TSHRKMT2AMEN1ALDH1A1 | |
| Malonic Acid Diethyl Ester SCHEMBL14880154 | 0.75 | MEN1 (0.56) | TSHRL3MBTL1LTA4HKMT2AMEN1 |
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-109942424-A | A kind of n-butyl acrylate heavy constituent recovery process and device | 泰兴金江化学工业有限公司 | 2019-06-28 | — | — | CN | disclosed |