Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| P-Xylene SCHEMBL10349865 | 0.85 | ALDH1A1 (0.72) | ALDH1A1CYP3A4CA2KDM4ELMNA | |
| Benzene SCHEMBL28267328 | 0.84 | ALDH1A1 (0.86) | ALDH1A1CYP3A4CA2KDM4ELMNA | |
| P-Xylene SCHEMBL11702881 | 0.83 | ALDH1A1 (0.50) | ALDH1A1CYP3A4CA2KDM4ELMNA | |
| Benzyl Alcohol SCHEMBL23753729 | 0.82 | ALDH1A1 (0.62) | ALDH1A1CYP3A4CA2KDM4ELMNA | |
| SCHEMBL8420801 | 0.82 | — | — | |
| SCHEMBL16324 | 0.82 | — | — | |
| SCHEMBL6249719 | 0.82 | ALDH1A1 (1.00) | ALDH1A1CYP3A4CA2LMNATDP1 | |
| SCHEMBL9492501 | 0.82 | — | — | |
| O-Xylene SCHEMBL17007543 | 0.80 | ALDH1A1 (0.68) | ALDH1A1CYP3A4CA2KDM4ELMNA | |
| Phenylethyl Alcohol SCHEMBL11119641 | 0.80 | ALDH1A1 (0.58) | ALDH1A1CYP3A4CA2KDM4ELMNA |
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-0211722-B1 | SULFONATED AND SULFURIZED DETERGENT DISPERSANT ADDITIVES FOR LUBRICANT OILS | OROGIL (FR) | 1990-05-23 | — | — | EP | claimed |