Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Phenylethyl Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.70 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Phenylethyl Alcohol SCHEMBL11422845 | 0.91 | TDP1 (0.76) | TDP1TRPA1CA2TSHRALDH1A1 | |
| Phenylethyl Alcohol SCHEMBL28557546 | 0.89 | TDP1 (0.73) | TDP1TRPA1CA2TSHRALDH1A1 | |
| Phenylethyl Alcohol SCHEMBL15391067 | 0.86 | TDP1 (0.61) | TDP1TRPA1CA2TSHRALDH1A1 | |
| Phenylethyl Alcohol SCHEMBL28131394 | 0.85 | TDP1 (0.67) | TDP1TRPA1 | |
| Phenylethyl Alcohol SCHEMBL10904935 | 0.84 | TDP1 (0.89) | TDP1CA2TSHRALDH1A1CYP4F2 | |
| Phenylethyl Alcohol SCHEMBL1838 | 0.83 | — | — | |
| Phenylethyl Alcohol SCHEMBL8160725 | 0.83 | TDP1 (0.64) | TDP1TRPA1TSHRKDM4ECYP2C9 | |
| Phenylethyl Alcohol SCHEMBL21905692 | 0.83 | TDP1 (0.64) | TDP1TSHRALDH1A1CYP4F2CYP4A11 | |
| Phenylethyl Alcohol SCHEMBL1867158 | 0.83 | TDP1 (1.00) | TDP1CA2TSHRALDH1A1CYP4F2 | |
| Phenylethyl Alcohol SCHEMBL8968173 | 0.83 | TDP1 (1.00) | TDP1CA2TSHRALDH1A1CYP4F2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102492550-B | Leather essence for synthetic leather and preparation method thereof | SHANGHAI INST TECHNOLOGY | 2013-04-03 | — | — | CN | claimed |
| CN-102492550-A | Leather essence for synthetic leather and preparation method thereof | SHANGHAI INST TECHNOLOGY | 2012-06-13 | — | — | CN | claimed |
| CN-112345486-B | Method for judging solvent used by monomer perfume raw material solution based on near infrared spectrum technology | 湖南中烟工业有限责任公司 | 2022-06-14 | — | — | CN | disclosed |
| CN-110419766-A | A kind of microemulsion gel base tobacco moist-keeping flavouring agent and the preparation method and application thereof | GANSU TOBACCO IND CO LTD | 2019-11-08 | — | — | CN | disclosed |
| CN-102492550-B | Leather essence for synthetic leather and preparation method thereof | SHANGHAI INST TECHNOLOGY | 2013-04-03 | — | — | CN | disclosed |
| CN-102492550-A | Leather essence for synthetic leather and preparation method thereof | SHANGHAI INST TECHNOLOGY | 2012-06-13 | — | — | CN | disclosed |