Propionic Acid

Propionic Acid

SCHEMBL5515586

CC(=O)O.CC(C)(C)CCCCCCCC(=O)O.CCC(=O)O

nearest known ligand 0.50

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Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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 20)

geneUniProtsupporting neighboursconfidence
ESR1 known ✓ P03372 1/20 0.50
GPR84 Q9NQS5 7/20 0.50
PPARG P37231 7/20 0.50
PPARD Q03181 7/20 0.50
PPARA Q07869 7/20 0.50
HDAC11 Q96DB2 5/20 0.50
TSHR P16473 5/20 0.50
PTPN1 P18031 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TLR2 O60603 2/20 0.50
FABP4 P15090 2/20 0.50
KMT2A Q03164 2/20 0.50
FFAR1 O14842 2/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
MEN1 O00255 1/20 0.50
ALOX15 P16050 1/20 0.50
PDE4A P27815 1/20 0.50
PDE3A Q14432 1/20 0.50

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 SCHEMBL27747062 1.00 GPR84 (0.50) GPR84PPARGPPARDPPARAHDAC11
Propionic Acid SCHEMBL5513917 0.96 GPR84 (0.54) GPR84PPARGPPARDPPARAHDAC11
Propionic Acid SCHEMBL27371381 0.96 GPR84 (0.54) GPR84PPARGPPARDPPARAHDAC11
Acetic Acid SCHEMBL5512501 0.94 TSHR (0.55) GPR84PPARGPPARDPPARAHDAC11
Acetic Acid SCHEMBL27747008 0.94 TSHR (0.55) GPR84PPARGPPARDPPARAHDAC11
Acetic Acid SCHEMBL9240793 0.92 TSHR (0.52) GPR84PPARGPPARDPPARAHDAC11
Butyric Acid SCHEMBL27726180 0.90 GPR84 (0.54) GPR84PPARGPPARDPPARAHDAC11
Butyric Acid SCHEMBL5519685 0.90 GPR84 (0.54) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL25307961 0.89 TSHR (0.60) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL2142069 0.89 TSHR (0.60) GPR84PPARGPPARDPPARAHDAC11

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-20070053855-A1 Personal care products incorporating cellulosic fatty acid esters EASTMAN CHEMICAL COMPANY 2007-03-08 US disclosed