Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28541195 | 0.79 | ALDH1A1 (0.44) | ALDH1A1KDM4ECSNK1ECA2CYP3A4 | |
| SCHEMBL28793292 | 0.70 | ALDH1A1 (0.40) | ALDH1A1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL28909976 | 0.69 | ALDH1A1 (0.41) | ALDH1A1KDM4ECA2CYP3A4POLB | |
| SCHEMBL8281048 | 0.68 | ALDH1A1 (0.53) | ALDH1A1KDM4ECA2CYP3A4POLB | |
| SCHEMBL28793291 | 0.68 | ALDH1A1 (0.42) | ALDH1A1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL28221097 | 0.66 | ALDH1A1 (0.47) | ALDH1A1KDM4ECA2CYP3A4POLB | |
| SCHEMBL8543593 | 0.65 | ALDH1A1 (0.46) | ALDH1A1KDM4ECA2CYP3A4POLB | |
| Phenylethyl Alcohol SCHEMBL11119641 | 0.65 | ALDH1A1 (0.58) | ALDH1A1KDM4ECA2CYP3A4CNR2 | |
| Benzyl Alcohol SCHEMBL23753729 | 0.64 | ALDH1A1 (0.62) | ALDH1A1KDM4ECSNK1EHDAC3HDAC4 | |
| SCHEMBL1278230 | 0.64 | ALDH1A1 (0.41) | ALDH1A1KDM4ECSNK1ECA2CYP3A4 |
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-114651023-A | Hydrophobically modified alkylene oxide polymer blends | 罗门哈斯公司 | 2022-06-21 | — | — | CN | claimed |