Linolenic Acid

Linolenic Acid

SCHEMBL6140641

CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)[O-].CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)[O-].CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)[O-].[Bi+3]

nearest known ligand 0.96

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Known targets — ChEMBL curated mechanism

HRH2

The experimentally established mechanism targets of Linolenic 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
FABP3 P05413 9/20 0.96
ALDH1A1 P00352 5/20 0.69
F7 P08709 3/20 0.69
F3 P13726 3/20 0.69
CYP19A1 P11511 3/20 0.69
MAPT P10636 2/20 0.69
CYP3A4 P08684 2/20 0.69
ALOX15 P16050 2/20 0.69
HSD17B10 Q99714 2/20 0.69
TDP1 Q9NUW8 2/20 0.69
OXER1 Q8TDS5 2/20 0.69
PTGS1 P23219 2/20 0.69
PPARG P37231 2/20 0.69
KMT2A Q03164 2/20 0.69
PPARD Q03181 2/20 0.69
PPARA Q07869 2/20 0.69
KDM4E B2RXH2 1/20 0.69
MEN1 O00255 1/20 0.69
FFAR1 O14842 1/20 0.69
NR1I2 O75469 1/20 0.69

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
Linolenic Acid SCHEMBL104456 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1
Linolenic Acid SCHEMBL4853105 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1
Linolenic Acid SCHEMBL446226 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1
Linolenic Acid SCHEMBL2410422 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1
Linolenic Acid SCHEMBL4918659 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1
SCHEMBL25403260 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1
Linolenic Acid SCHEMBL4409873 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1
Linolenic Acid SCHEMBL4921337 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1
Linolenic Acid SCHEMBL666389 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1
Linolenic Acid SCHEMBL539075 0.96 FABP3 (0.96) FABP3ALDH1A1F7F3CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1519974-B1 MICRO-CELLULAR OR NON-CELLULAR LIGHT-STABLE POLYURETHANE MATERIAL AND METHOD FOR THE PRODUCTION THEREOF BASF SE (DE) 2017-08-09 EP disclosed
EP-1519974-A1 MICRO-CELLULAR OR NON-CELLULAR LIGHT-STABLE POLYURETHANE MATERIAL AND METHOD FOR THE PRODUCTION THEREOF RECTICEL (BE) 2005-04-06 EP disclosed
US-20040019175-A1 Micro-cellular or non-cellular light-stable polyurethane material and method for the production thereof RECTICEL 2004-01-29 US disclosed
WO-2004000905-A1 MICRO-CELLULAR OR NON-CELLULAR LIGHT-STABLE POLYURETHANE MATERIAL AND METHOD FOR THE PRODUCTION THEREOF RECTICEL (BE) 2003-12-31 WO disclosed