Butyric Acid

Butyric Acid

SCHEMBL3045760

CCCC(=O)[O-].CCCC(=O)[O-].[Ca+2].[MgH2]

nearest known ligand 0.88

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Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.88
HDAC3 O15379 3/20 0.88
HDAC1 Q13547 3/20 0.88
HDAC2 Q92769 3/20 0.88
HDAC8 Q9BY41 3/20 0.88
CA1 P00915 3/20 0.57
CES2 O00748 2/20 0.56
CES1 P23141 2/20 0.56
NFKB1 P19838 1/20 0.46
GPR84 Q9NQS5 1/20 0.45
FABP3 P05413 2/20 0.43
TSHR P16473 1/20 0.43
CA2 P00918 1/20 0.43

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
Butyric Acid SCHEMBL18039002 0.97 FFAR3 (0.93) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL123022 0.97 FFAR3 (0.93) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL1070956 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL6837781 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL7721221 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL28795150 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL8989559 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL6234019 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL17261591 0.94 FFAR3 (0.94) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL11419652 0.90 FFAR3 (0.93) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150080403-A1 METHODS AND COMPOSITIONS FOR TREATING PARKINSON'S DISEASE NEUROLIPID RESEARCH FOUNDATION, INC (US) 2015-03-19 US disclosed
US-20100022444-A1 COMBINATION THERAPY FOR MODULATION OF ACTIVITY AND DEVELOPMENT OF CELLS AND TISSUES BODYBIO, INC. (US) 2010-01-28 US disclosed
US-20080254017-A1 Methods and compositions for treating symptomes of diseases related to imbalance of essential fatty acids BODYBIO, INC. (US) 2008-10-16 US disclosed
US-20070004639-A1 Methods and compositions for treating Parkinson's disease BODYBIO, INC. (US) 2007-01-04 US disclosed