Oleic Acid

Oleic Acid

SCHEMBL1203413

CCCCCCCC/C=C\CCCCCCCC(=O)[O-].CCCCCCCC/C=C\CCCCCCCC(=O)[O-].CCCCCCCC/C=C\CCCCCCCC(=O)[O-].CCCCCCCC/C=C\CCCCCCCC(=O)[O-].[Ca+2].[Fe+2]

nearest known ligand 0.92

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Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Oleic 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
PTGS1 known ✓ P23219 1/20 0.63
FABP3 P05413 9/20 0.92
TERT O14746 3/20 0.63
MAPT P10636 2/20 0.63
BLM P54132 2/20 0.63
HSD17B10 Q99714 2/20 0.63
FABP4 P15090 2/20 0.63
GMNN O75496 1/20 0.63
USP2 O75604 1/20 0.63
LMNA P02545 1/20 0.63
CYP1A2 P05177 1/20 0.63
POLB P06746 1/20 0.63
CYP2C9 P11712 1/20 0.63
ALOX15 P16050 1/20 0.63
APEX1 P27695 1/20 0.63
CYP2C19 P33261 1/20 0.63
RECQL P46063 1/20 0.63
NPSR1 Q6W5P4 1/20 0.63
DUSP3 P51452 1/20 0.63
MMP2 P08253 1/20 0.63

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
SCHEMBL29378362 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10
SCHEMBL29375876 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10
Erucic Acid SCHEMBL31135511 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10
Vaccenic Acid SCHEMBL15452907 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10
Oleic Acid SCHEMBL15811770 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10
Oleic Acid SCHEMBL136955 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10
Oleic Acid SCHEMBL15811776 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10
Oleic Acid SCHEMBL29196 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10
Palmitoleic Acid SCHEMBL22501310 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10
Vaccenic Acid SCHEMBL29378364 0.98 FABP3 (0.96) FABP3TERTMAPTBLMHSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110033368-A1 METHODS OF FORMING A NANOCRYSTAL AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2011-02-10 US disclosed
CN-101955774-A Nanocrystalline painted plant AGENCY SCIENCE TECH & RES 2011-01-26 CN disclosed
WO-2009045177-A1 METHODS OF FORMING A NANOCRYSTAL AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2009-04-09 WO disclosed