Butyric Acid

Butyric Acid

SCHEMBL6234019

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

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

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
HDAC3 known ✓ O15379 3/20 0.88
HDAC1 known ✓ Q13547 3/20 0.88
HDAC2 known ✓ Q92769 3/20 0.88
HDAC8 known ✓ Q9BY41 3/20 0.88
FFAR3 O14843 3/20 0.88
CA1 P00915 2/20 0.57
CES1 P23141 3/20 0.56
CES2 O00748 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 SCHEMBL8989559 1.00 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL6837781 1.00 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL18039002 0.97 FFAR3 (0.93) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL123022 0.97 FFAR3 (0.93) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL4888901 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL11859270 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL6746198 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL17261591 0.94 FFAR3 (0.94) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL3045760 0.94 FFAR3 (0.88) FFAR3HDAC3HDAC1HDAC2HDAC8
Butyric Acid SCHEMBL6747970 0.94 FFAR3 (0.88) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1108291-C Process for preparing substituted perhydroisoindoles ADIR CO (FR) 2003-05-14 CN claimed
CN-1261879-A Process for preparing substituted perhydroisoindoles ADIR CO (FR) 2000-08-02 CN claimed
CN-1634885-B Novel mitiglinide crystalline form and its preparing process BEIJING LELIJIAN BIOTECHNOLOGY CO LTD 2011-05-04 CN disclosed
CN-1634885-A Novel mitiglinide crystalline form and its preparing process BEIJING FU KANG REN BIO PHARM (CN) 2005-07-06 CN disclosed
EP-0976757-B1 A method of purifying vitamin B12 and/or derivatives thereof NIPPON MITSUBISHI OIL CORP (JP) 2005-06-01 EP disclosed
CN-1108291-C Process for preparing substituted perhydroisoindoles ADIR CO (FR) 2003-05-14 CN disclosed
CN-1261879-A Process for preparing substituted perhydroisoindoles ADIR CO (FR) 2000-08-02 CN disclosed
EP-0976757-A2 A method of purifying vitamin B12 and/or derivatives thereof Nippon Mitsubishi Oil Corporation (JP) 2000-02-02 EP disclosed