Propionic Acid

Propionic Acid

SCHEMBL27313796

CC(=O)O.CC(=O)O.CCC(=O)O.CCC(=O)O.O=CO.O=CO

nearest known ligand 0.62

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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 0.32
FFAR3 O14843 3/20 0.62
ALDH1A1 P00352 5/20 0.44
TDP1 Q9NUW8 4/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
LMNA P02545 1/20 0.36
SLC15A2 Q16348 1/20 0.36
TSHR P16473 5/20 0.35
ALOX15 P16050 2/20 0.33
AKR1B1 P15121 1/20 0.33
CYP2D6 P10635 1/20 0.33
PPARG P37231 6/20 0.32
PPARD Q03181 6/20 0.32
PPARA Q07869 6/20 0.32
GPR84 Q9NQS5 5/20 0.32

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 SCHEMBL7459031 1.00 FFAR3 (0.62) FFAR3ALDH1A1TDP1LCKFYN
Propionic Acid SCHEMBL9619152 0.94 FFAR3 (0.71) FFAR3ALDH1A1TDP1HDAC3HDAC1
Propionic Acid SCHEMBL15260565 0.94 FFAR3 (0.71) FFAR3ALDH1A1TDP1HDAC3HDAC1
Propionic Acid SCHEMBL1258739 0.94
Propionic Acid SCHEMBL5342228 0.94 FFAR3 (0.71) FFAR3ALDH1A1TDP1HDAC3HDAC1
Propionic Acid SCHEMBL27672329 0.94 FFAR3 (0.71) FFAR3ALDH1A1TDP1HDAC3HDAC1
Propionic Acid SCHEMBL9619149 0.94 FFAR3 (0.71) FFAR3ALDH1A1TDP1HDAC3HDAC1
Propionic Acid SCHEMBL5689701 0.89 FFAR3 (0.50) FFAR3ALDH1A1TDP1LCKFYN
Propionic Acid SCHEMBL19458358 0.88 FFAR3 (0.62) FFAR3ALDH1A1TDP1HDAC3HDAC1
Benzene SCHEMBL2386401 0.88 FFAR3 (0.62) FFAR3ALDH1A1TDP1HDAC3HDAC1

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
CN-1032212-C N-protected alpha-L-aspartyl-L-methyl phenylalaninate MITSUI TOATSU CHEMICALS (JP) 1996-07-03 CN disclosed