Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Ethyl Acetate. 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 | 6/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GALR3 | O60755 | 2/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Ethyl Acetate SCHEMBL65476 | 0.96 | ALDH1A1 (0.58) | ALDH1A1LMNAHSD17B10TSHRTDP1 | |
| Ethyl Acetate SCHEMBL28009515 | 0.92 | ALDH1A1 (0.54) | ALDH1A1LMNAHSD17B10TSHRTDP1 | |
| Ethyl Acetate SCHEMBL564571 | 0.90 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TSHRTDP1 | |
| Ethyl Acetate SCHEMBL28957278 | 0.90 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TSHRTDP1 | |
| Ethyl Acetate SCHEMBL28454300 | 0.90 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TSHRTDP1 | |
| Ethyl Acetate SCHEMBL4580290 | 0.89 | ALDH1A1 (0.50) | ALDH1A1LMNAHSD17B10TSHRTDP1 | |
| Ethyl Acetate SCHEMBL7707782 | 0.88 | ALDH1A1 (0.64) | ALDH1A1LMNAHSD17B10TSHRTDP1 | |
| Ethyl Acetate SCHEMBL239885 | 0.88 | ALDH1A1 (0.70) | ALDH1A1LMNAHSD17B10TSHRCHRM5 | |
| 1,3-Butanediol SCHEMBL4329597 | 0.87 | ALDH1A1 (0.52) | ALDH1A1LMNAHSD17B10TSHRGALR3 | |
| Ethyl Acetate SCHEMBL4578201 | 0.86 | ALDH1A1 (0.47) | ALDH1A1LMNAHSD17B10TSHRTDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021029396-A1 | COMPOUND, (CO)POLYMER, COMPOSITION, AND PATTERN FORMING METHOD | 三菱瓦斯化学株式会社 | 2021-02-18 | — | — | WO | disclosed |
| WO-2021029395-A1 | COMPOUND, POLYMER, COMPOSITION, COMPOSITION FOR FILM FORMATION, PATTERN FORMING METHOD, METHOD FOR FORMING INSULATING FILM, METHOD FOR PRODUCING COMPOUND, IODINE-CONTAINING VINYL POLYMER AND METHOD FOR PRODUCING ACETYLATED DERIVATIVE OF SAME | 三菱瓦斯化学株式会社 | 2021-02-18 | — | — | WO | disclosed |
| WO-2020145407-A1 | POLYCYCLIC POLYPHENOL RESIN AND PRODUCTION METHOD FOR POLYCYCLIC POLYPHENOL RESIN | 三菱瓦斯化学株式会社 | 2020-07-16 | — | — | WO | disclosed |
| WO-2020145406-A1 | FILM FORMING COMPOSITION, RESIST COMPOSITION, RADIATION-SENSITIVE COMPOSITION, METHOD FOR PRODUCING AMORPHOUS FILM, RESIST PATTERN FORMATION METHOD, COMPOSITION FOR FORMING LOWER LAYER FILM FOR LITHOGRAPHY, METHOD FOR PRODUCING LOWER LAYER FILM FOR LITHOGRAPHY, AND CIRCUIT PATTERN FORMATION METHOD | 三菱瓦斯化学株式会社 | 2020-07-16 | — | — | WO | disclosed |