Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Acetic Acid Butyl Ester. 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 | 2/20 | 0.72 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.42 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Acetic Acid Butyl Ester SCHEMBL28255898 | 0.96 | ALDH1A1 (0.67) | ALDH1A1ATMTSHRHPGDCHRM5 | |
| Acetic Acid Pentyl Ester SCHEMBL27685689 | 0.94 | ALDH1A1 (0.63) | ALDH1A1TSHRMAPTHCAR2KDM4E | |
| Acetic Acid Butyl Ester SCHEMBL107642 | 0.93 | ALDH1A1 (0.62) | ALDH1A1ATMTSHRHPGDCHRM5 | |
| Acetic Acid Butyl Ester SCHEMBL28292507 | 0.93 | ALDH1A1 (0.62) | ALDH1A1ATMTSHRHPGDCHRM5 | |
| Octyl Acetate SCHEMBL27849660 | 0.92 | ALDH1A1 (0.61) | ALDH1A1TSHRMAPTKDM4EDUSP3 | |
| Tetradecylacetate SCHEMBL633019 | 0.92 | ALDH1A1 (0.61) | ALDH1A1TSHRMAPTKDM4EDUSP3 | |
| Acetic Acid Pentyl Ester SCHEMBL27678839 | 0.91 | ALDH1A1 (0.60) | ALDH1A1TSHRMAPT | |
| Acetic Acid Butyl Ester SCHEMBL16738067 | 0.90 | ALDH1A1 (0.75) | ALDH1A1ATMTSHRHPGDCHRM5 | |
| Acetic Acid Butyl Ester SCHEMBL4470736 | 0.90 | ALDH1A1 (0.58) | ALDH1A1ATMTSHRHPGDCHRM5 | |
| Acetic Acid Butyl Ester SCHEMBL3043571 | 0.90 | ALDH1A1 (0.82) | ALDH1A1ATMTSHRHPGDCHRM5 |
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 80 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107011791-B | A kind of organic-inorganic composite shop primer of not zincilate and preparation method thereof | 苏州吉人高新材料股份有限公司 | 2019-10-01 | — | — | CN | claimed |
| CN-120092028-A | Random copolymer, coating composition containing the same, and resist composition | DIC株式会社 | 2025-06-03 | — | — | CN | disclosed |
| CN-119768737-A | Developer-resistant resist underlayer film composition and method for producing resist pattern | 默克专利有限公司 | 2025-04-04 | — | — | CN | disclosed |
| CN-119654359-A | Silicone-containing copolymer, leveling agent, coating composition, resist composition, color filter, and method for producing silicone-containing copolymer | DIC株式会社 | 2025-03-18 | — | — | CN | disclosed |
| CN-119546660-A | Silicone-containing copolymer, leveling agent, coating composition, resist composition, color filter, and method for producing silicone-containing copolymer | DIC株式会社 | 2025-02-28 | — | — | CN | disclosed |
| CN-119212622-A | Electrode device for living body | 凸版控股株式会社 | 2024-12-27 | — | — | CN | disclosed |
| CN-115362216-B | Composition for forming film | 日产化学株式会社 | 2024-07-19 | — | — | CN | disclosed |
| WO-2024063044-A1 | COMPOSITION FOR FORMING SILICON-CONTAINING RESIST UNDERLAYER FILM | 日産化学株式会社 | 2024-03-28 | — | — | WO | disclosed |
| WO-2024019064-A1 | SILICON-CONTAINING RESIST UNDERLAYER FILM-FORMING COMPOSITION CONTAINING POLYFUNCTIONAL SULFONIC ACID | 日産化学株式会社 | 2024-01-25 | — | — | WO | disclosed |
| WO-2024009993-A1 | METHOD OF MANUFACTURING LAMINATE AND METHOD OF MANUFACTURING SEMICONDUCTOR ELEMENT | 日産化学株式会社 | 2024-01-11 | — | — | WO | disclosed |
| US-20030059628-A1 | Stacked film, method for the formation of stacked film, insulating film, and substrate for semiconductor | JSR CORPORATION (JP) | 2003-03-27 | — | — | US | disclosed |
| EP-1295924-A2 | Stacked film, method for the formation of stacked film, insulating film, and substrate for semiconductor | JSR Corporation (JP) | 2003-03-26 | — | — | EP | disclosed |
| US-6444842-B1 | CATALYTIC ESTERIFICATION; DISTILLATION | CELANESE INTERNATIONAL CORPORATION | 2002-09-03 | — | — | US | disclosed |
| WO-1999023058-A1 | CONTINUOUS PROCESS FOR THE PRODUCTION OF CARBOXYLIC ACID ESTERS OF ALKYLENE GLYCOL MONOALKYL ETHERS | CELANESE INTERNATIONAL CORPORATION (US) | 1999-05-14 | — | — | WO | disclosed |
| US-5578377-A | ANTIREFLECTIVE FILM | ASAHI GLASS COMPANY LTD. (JP) | 1996-11-26 | — | — | US | disclosed |
| EP-0119833-B1 | PREPARATION OF CARBOXYLIC ACID ESTERS OF ALKYLENE GLYCOL MONOALKYL ETHERS | ARCO CHEMICAL TECHNOLOGY, INC. (US) | 1988-11-17 | — | — | EP | disclosed |
| EP-0163522-B1 | STRIPPING OF UNREACTED GLYCOL ETHERS AND ACIDS FROM AN ESTERIFICATION REACTION MIXTURE | ARCO CHEMICAL TECHNOLOGY, INC. (US) | 1988-09-07 | — | — | EP | disclosed |
| EP-0163522-A2 | Stripping of unreacted glycol ethers and acids from an esterification reaction mixture | ARCO CHEMICAL TECHNOLOGY, INC. (US) | 1985-12-04 | — | — | EP | disclosed |
| US-4544453-A | AZEOTROPIC DISTILLATION, SOLVENT EXTRACTION | ATLANTIC RICHFIELD COMPANY (US) | 1985-10-01 | — | — | US | disclosed |
| EP-0119833-A2 | Preparation of carboxylic acid esters of alkylene glycol monoalkyl ethers | ARCO CHEMICAL TECHNOLOGY, INC. (US) | 1984-09-26 | — | — | EP | disclosed |