Propionic Acid

Propionic Acid

SCHEMBL7719958

CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].[Mg+2].[Zn+2]

nearest known ligand 0.85

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ATP4AATP4BGABBR1GABBR2HMGCR

The experimentally established mechanism targets of Propionic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.50
HDAC3 O15379 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
TDP1 Q9NUW8 2/20 0.44
CA4 P22748 2/20 0.44
ALDH1A1 P00352 1/20 0.44
CA1 P00915 3/20 0.43
CASP1 P29466 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
CA2 P00918 1/20 0.38
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
NFKB1 P19838 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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 SCHEMBL148207 0.96 FFAR3 (0.53) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL240639 0.96 FFAR3 (0.53) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL30418124 0.96 FFAR3 (0.53) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL28959625 0.92 FFAR3 (0.50) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL29172904 0.92 FFAR3 (0.50) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL28594617 0.92 FFAR3 (0.50) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL30385704 0.92
Propionic Acid SCHEMBL1118869 0.92 FFAR3 (0.50) FFAR3HDAC3HDAC1HDAC2HDAC8
Propionic Acid SCHEMBL9497757 0.92
Propionic Acid SCHEMBL2259937 0.89 CA1 (0.57) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6391598-B1 GENERATING PREFERENTIAL FATTY ACID COMPOUNDS; OBTAIN ANIMAL RUMINAL FLUID, INCUBATE WITH METAL OXIDE, RECOVER PREFERENTIAL FATTY ACID COMPOUND BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA 2002-05-21 US claimed