Known targets — ChEMBL curated mechanism
CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Butyl Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | ALB | P02768 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | G6PD | P11413 | 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 | |
|---|---|---|---|---|
| Butyl Alcohol SCHEMBL359237 | 0.96 | ALDH1A1 (0.45) | ALDH1A1CYP2C9LMNATSHRALB | |
| Alcohol SCHEMBL28400814 | 0.87 | GAA (0.50) | ALDH1A1CYP2C9LMNATDP1CYP2C19 | |
| Butyl Alcohol SCHEMBL9636993 | 0.84 | ALDH1A1 (0.46) | ALDH1A1CYP2C9LMNATSHRALB | |
| Alcohol SCHEMBL15063851 | 0.83 | GAA (0.50) | ALDH1A1CYP2C9LMNATDP1CYP2C19 | |
| Alcohol SCHEMBL9198841 | 0.83 | GAA (0.50) | ALDH1A1CYP2C9LMNATDP1CYP2C19 | |
| Butyl Alcohol SCHEMBL359238 | 0.82 | ALDH1A1 (0.45) | ALDH1A1CYP2C9LMNATSHRALB | |
| Butyl Alcohol SCHEMBL28577427 | 0.81 | ALDH1A1 (0.44) | ALDH1A1CYP2C9LMNATSHRALB | |
| SCHEMBL10599444 | 0.81 | CYP3A4 (0.43) | ALDH1A1CYP2C9LMNATSHRCYP2C19 | |
| Methyl Alcohol SCHEMBL21523587 | 0.80 | GAA (0.56) | ALDH1A1CYP2C9LMNATDP1CYP2C19 | |
| P-Xylene SCHEMBL3200566 | 0.80 | ALDH1A1 (0.61) | ALDH1A1CYP2C9LMNATSHRALB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109369339-B | Method for treating waste p-toluenesulfonic acid iron n-butanol solution | 惠州市宙邦化工有限公司 | 2021-09-17 | — | — | CN | claimed |
| CN-109369339-B | Method for treating waste p-toluenesulfonic acid iron n-butanol solution | 惠州市宙邦化工有限公司 | 2021-09-17 | — | — | CN | disclosed |
| CN-107818872-B | Graphene-conductive polymer-nanocarbon wall composite material, and manufacturing method and application thereof | 广州墨羲科技有限公司 | 2021-09-14 | — | — | CN | disclosed |
| WO-2020224630-A1 | CONDUCTIVE POLYMER, CAPACITOR AND PREPARATION METHOD THEREFOR | 深圳新宙邦科技股份有限公司 | 2020-11-12 | — | — | WO | disclosed |
| CN-111909362-A | Conductive polymer, capacitor and preparation method thereof | 深圳新宙邦科技股份有限公司 | 2020-11-10 | — | — | CN | disclosed |