Butyric Acid

Butyric Acid

SCHEMBL9464243

CC(=O)[O-].CCCC(=O)[O-].[K+].[Na+]

nearest known ligand 0.83

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Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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 12)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.83
HDAC3 O15379 2/20 0.83
HDAC1 Q13547 2/20 0.83
HDAC2 Q92769 2/20 0.83
HDAC8 Q9BY41 2/20 0.83
CA1 P00915 4/20 0.59
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
NFKB1 P19838 1/20 0.48
GPR84 Q9NQS5 1/20 0.47
CA4 P22748 1/20 0.45
FABP3 P05413 3/20 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 SCHEMBL10693392 0.97 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL1071415 0.94 FFAR3 (0.94) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL23094037 0.92 FFAR3 (0.82) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL10683851 0.92 FFAR3 (0.82) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL28787739 0.92 FFAR3 (0.82) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL10683859 0.92 FFAR3 (0.82) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL30072232 0.92 FFAR3 (0.82) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL5502287 0.92 FFAR3 (0.82) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL4292004 0.91 FFAR3 (1.00) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL1331084 0.91

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-5183931-A Catalyzing with carboxylic acid medium in presence of palladium salt, metal persulfate, metal salt and tin salt PHILLIPS PETROLEUM COMPANY (US) 1993-02-02 US disclosed