Propionic Acid

Propionic Acid

SCHEMBL5025372

CCC(=O)O.CCCNC(C)O

nearest known ligand 0.46

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.46
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP9 P14780 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
SIGMAR1 Q99720 1/20 0.34
PGR P06401 1/20 0.34
SCN1A P35498 1/20 0.34
SCN2A Q99250 1/20 0.34
SCN3A Q9NY46 1/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
GPR84 Q9NQS5 4/20 0.32
TP53 P04637 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.

Compoundsimilaritytop predictedshared targets
Acetic Acid SCHEMBL5025245 0.88 MMP1 (0.37) FFAR3MMP1MMP2MMP3MMP9
Propionic Acid SCHEMBL5027755 0.87 ALOX15 (0.42) FFAR3GPR84MEN1KMT2AFFAR4
SCHEMBL143667 0.85
Hydrochloric Acid SCHEMBL27749744 0.83
Dimethylamine SCHEMBL28484776 0.80 SIGMAR1 (0.34) MMP1MMP2MMP3MMP9SIGMAR1
Glycolic Acid SCHEMBL5027788 0.77 ALOX15 (0.41) GPR84MEN1KMT2AFFAR4FFAR1
SCHEMBL8369782 0.76
Acetic Acid SCHEMBL5027803 0.76 ALOX15 (0.43) MMP2GPR84MEN1KMT2AFFAR1
Propionic Acid SCHEMBL1834961 0.75 FFAR3 (0.56) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL1830525 0.75 FFAR3 (0.56) FFAR3HDAC3HDAC1HDAC2HDAC8

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101316810-A Ionic liquids BIONIQS LTD (GB) 2008-12-03 CN disclosed
US-20080221361-A1 Ionic Liquids BIONIQS LIMITED (GB) 2008-09-11 US disclosed