Ethyl Acetate

Ethyl Acetate

SCHEMBL29038293

CCCCCCCCCC(Cl)Cl.CCOC(C)=O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
LMNA P02545 1/20 0.52
HSD17B10 Q99714 1/20 0.52
ZDHHC7 Q9NXF8 1/20 0.44
FAAH O00519 3/20 0.42
GPR84 Q9NQS5 7/20 0.41
FFAR1 O14842 1/20 0.41
MAPT P10636 2/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA2 P00918 1/20 0.39

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.

Compoundsimilaritytop predictedshared targets
Ethyl Acetate SCHEMBL278533 1.00 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10ZDHHC7FAAH
Ethyl Acetate SCHEMBL148560 1.00 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10ZDHHC7FAAH
Ethyl Acetate SCHEMBL1268307 1.00 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10ZDHHC7FAAH
Ethyl Acetate SCHEMBL8532167 0.98 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10ZDHHC7FAAH
Ethyl Acetate SCHEMBL28478460 0.98 ALDH1A1 (0.54) ALDH1A1LMNAHSD17B10ZDHHC7FAAH
Heptane SCHEMBL4621147 0.88 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10ZDHHC7FAAH
Heptane SCHEMBL17105901 0.87 ALDH1A1 (0.54) ALDH1A1LMNAHSD17B10FAAHMAPT
Heptane SCHEMBL4126646 0.86 ALDH1A1 (0.58) ALDH1A1LMNAHSD17B10ZDHHC7FAAH
Hexane SCHEMBL8542408 0.86 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10ZDHHC7FAAH
Hexane SCHEMBL133237 0.86 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10ZDHHC7FAAH

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116474822-A Preparation method of activated carbon-loaded modified photosensitive catalyst for removing formaldehyde 西北农林科技大学 2023-07-25 CN disclosed