Propionic Acid

Propionic Acid

SCHEMBL23044698

CCC(=O)O.CCC(=O)OCC[N+](C)(C)C

nearest known ligand 0.61

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.61
ADRA1A P35348 1/20 0.61
MAPT P10636 1/20 0.59
BLM P54132 1/20 0.59
CYP2C19 P33261 2/20 0.57
CHRM1 P11229 8/20 0.56
CHRM3 P20309 8/20 0.56
CHRM2 P08172 7/20 0.56
CHRM4 P08173 7/20 0.56
CHRM5 P08912 6/20 0.56
CHRNB2 P17787 4/20 0.56
CHRNA4 P43681 4/20 0.56
CHRNA7 P36544 3/20 0.56
HTR1A P08908 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
PGR P06401 1/20 0.56
TBXA2R P21731 1/20 0.56
CHRNB4 P30926 1/20 0.56
CHRNA3 P32297 1/20 0.56
CHRNA10 Q9GZZ6 1/20 0.56

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
Propionic Acid SCHEMBL19617436 0.98 ADRA2A (0.59) ADRA2AADRA1AMAPTBLMCYP2C19
SCHEMBL2303835 0.93 ADRA2A (0.70) ADRA2AADRA1AMAPTBLMCYP2C19
Hydrochloric Acid SCHEMBL3430810 0.91 MAPT (0.71) ADRA2AADRA1AMAPTBLMCYP2C19
Bromide SCHEMBL21643594 0.91 ADRA2A (0.67) ADRA2AADRA1AMAPTBLMCYP2C19
Iodide SCHEMBL11128066 0.91 ADRA2A (0.67) ADRA2AADRA1AMAPTBLMCYP2C19
Hydrochloric Acid SCHEMBL19025644 0.91 ADRA2A (0.67) ADRA2AADRA1AMAPTBLMCYP2C19
Choline SCHEMBL31574099 0.85 ADRA2A (0.59) ADRA2AADRA1AMAPTBLMCYP2C19
Acetylcholine SCHEMBL28638398 0.85 CHRM1 (0.79) ADRA2AADRA1AMAPTBLMCYP2C19
SCHEMBL290569 0.83 ADRA2A (0.57) ADRA2AADRA1AMAPTBLMCYP2C19
Benzene SCHEMBL25192521 0.83 CHRM1 (0.52) ADRA2AADRA1AMAPTBLMCYP2C19

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110804893-B Method for separating holocellulose in wood fibers by using choline eutectic solvent 齐鲁工业大学 2021-11-30 CN disclosed
WO-2021036156-A1 EUTECTIC SOLVENT AND APPLICATION THEREOF IN EXTRACTING LIGNIN 齐鲁工业大学 2021-03-04 WO disclosed
CN-110540508-B Eutectic solvent and application thereof in extracting lignin 齐鲁工业大学 2021-01-01 CN disclosed
CN-110804893-A Method for separating holocellulose in wood fibers by using choline eutectic solvent 齐鲁工业大学 2020-02-18 CN disclosed
CN-110540508-A Eutectic solvent and application thereof in extracting lignin UNIV QILU TECHNOLOGY 2019-12-06 CN disclosed