Stearic Acid

Stearic Acid

SCHEMBL11514728

CCCCCCCCCCCCCCCCCC(=O)[O-].CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.56

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Known targets — ChEMBL curated mechanism

rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.53
CES1 P23141 2/20 0.53
PPARG P37231 2/20 0.50
FABP3 P05413 7/20 0.49
PPARA Q07869 1/20 0.47
CA1 P00915 1/20 0.46
EPHX2 P34913 1/20 0.45

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
Succinic Acid SCHEMBL679440 0.88 CYP2C19 (0.50) CES2CES1PPARGCA1
Stearic Acid SCHEMBL4599006 0.86 CES2 (0.49) CES2CES1PPARGFABP3PPARA
Propionic Acid SCHEMBL1399930 0.83 CYP1A2 (0.47) CES2CES1
Bicarbonate SCHEMBL1144353 0.82 CYP1A2 (0.50) CES2CES1
Bicarbonate SCHEMBL11663344 0.82 CYP1A2 (0.50) CES2CES1
Octanoic Acid SCHEMBL2807929 0.81 CES2 (0.57) CES2CES1PPARGFABP3CA1
Dodecanoate SCHEMBL10935524 0.81 CES2 (0.57) CES2CES1PPARGFABP3CA1
Decanoic Acid SCHEMBL10862164 0.81 CES2 (0.57) CES2CES1PPARGFABP3CA1
Stearic Acid SCHEMBL11768053 0.81 CES2 (0.57) CES2CES1PPARGFABP3PPARA
Oxalic Acid SCHEMBL10577823 0.81 CYP1A2 (0.48) CES2CES1

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-4145473-A Antistatic filament having a polymeric sheath and a conductive polymeric core E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-03-20 US disclosed