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 | 5/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
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 SCHEMBL28454300 | 0.98 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| Ethyl Acetate SCHEMBL28957278 | 0.98 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| Ethyl Acetate SCHEMBL564571 | 0.98 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| Ethyl Acetate SCHEMBL28543086 | 0.93 | ALDH1A1 (0.61) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| Ethyl Acetate SCHEMBL65476 | 0.91 | ALDH1A1 (0.58) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| Ethyl Acetate SCHEMBL3835282 | 0.91 | ALDH1A1 (0.64) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| Ethyl Acetate SCHEMBL9032995 | 0.91 | ALDH1A1 (0.70) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| Ethyl Acetate SCHEMBL28098039 | 0.90 | ALDH1A1 (0.56) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| Ethyl Acetate SCHEMBL28009915 | 0.88 | ALDH1A1 (0.67) | ALDH1A1LMNAHSD17B10TDP1TSHR | |
| Ethyl Acetate SCHEMBL22207671 | 0.88 | ALDH1A1 (0.54) | ALDH1A1LMNAHSD17B10TDP1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104395824-B | Alkali developable photosensitive composition | 株式会社艾迪科 | 2020-01-31 | — | — | CN | disclosed |
| US-6355657-B1 | LOPERAMIDE HYDROCHLORIDE IN PROPYLENE CARBONATE AND ETHANOL | ATRIX LABORATORIES, INC. | 2002-03-12 | — | — | US | disclosed |