Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.49 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
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 SCHEMBL21905692 | 0.90 | TDP1 (0.64) | TDP1KMT2ACYP2C9CYP2C19CYP2D6 | |
| Phenylethyl Alcohol SCHEMBL183529 | 0.85 | TDP1 (0.76) | TDP1ALDH1A1CYP4F2CYP4A11KEAP1 | |
| Phenylethyl Alcohol SCHEMBL11422845 | 0.85 | TDP1 (0.76) | TDP1CYP2C9CYP2C19ALDH1A1TSHR | |
| Cadaverine Tartrate SCHEMBL27514486 | 0.83 | TDP1 (0.67) | TDP1ALDH1A1KEAP1KDM4ECYP1A2 | |
| Phenylethyl Alcohol SCHEMBL28557546 | 0.83 | TDP1 (0.73) | TDP1CYP2C9CYP2C19ALDH1A1TSHR | |
| Phenylethyl Alcohol SCHEMBL10904935 | 0.82 | TDP1 (0.89) | TDP1ALDH1A1TSHRCYP4F2CYP4A11 | |
| Phenylethyl Alcohol SCHEMBL1838 | 0.82 | — | — | |
| Phenylethyl Alcohol SCHEMBL1867158 | 0.82 | TDP1 (1.00) | TDP1ALDH1A1TSHRCYP4F2CYP4A11 | |
| Phenylethyl Alcohol SCHEMBL28820852 | 0.82 | TDP1 (1.00) | TDP1ALDH1A1TSHRCYP4F2CYP4A11 | |
| Phenylethyl Alcohol SCHEMBL11450063 | 0.82 | TDP1 (1.00) | TDP1ALDH1A1TSHRCYP4F2CYP4A11 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110078594-A | A kind of synthetic method of p-hydroxyphenylethanol | 新昌县泰如科技有限公司 | 2019-08-02 | — | — | CN | disclosed |
| CN-1147467-C | Cyclopentyl alkyl cyanide | ���ֵ���³����ʹ�˾ | 2004-04-28 | — | — | CN | disclosed |
| CN-1290691-A | Cyclopentyl alkyl cyanide | GIVAUDAN ROURE INTERNAT SA (CH) | 2001-04-11 | — | — | CN | disclosed |