Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6909668

CCO.O.O=C(O)C(F)(F)F

nearest known ligand 0.39

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Known targets — ChEMBL curated mechanism

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

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.39
ALDH1A1 P00352 3/20 0.38
TSHR P16473 3/20 0.38
CES1 P23141 6/20 0.37
CES2 O00748 3/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.37
FFAR3 O14843 1/20 0.37
FUCA1 P04066 1/20 0.37
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
EPHX1 P07099 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
Trifluoroacetic Acid SCHEMBL281599 0.97 FAAH (0.40) FAAHALDH1A1TSHRCES1CES2
Trifluoroacetic Acid SCHEMBL3794549 0.97 FAAH (0.40) FAAHALDH1A1TSHRCES1CES2
Trifluoroacetic Acid SCHEMBL30324569 0.97 FAAH (0.40) FAAHALDH1A1TSHRCES1CES2
Trifluoroacetic Acid SCHEMBL21924385 0.94 FAAH (0.39) FAAHALDH1A1TSHRCES1CES2
Trifluoroacetic Acid SCHEMBL27681955 0.94 FAAH (0.39) FAAHALDH1A1TSHRCES1CES2
Trifluoroacetic Acid SCHEMBL27627328 0.94 FAAH (0.39) FAAHALDH1A1TSHRCES1CES2
Trifluoroacetic Acid SCHEMBL29019101 0.91 FAAH (0.37) FAAHALDH1A1TSHRCES1CES2
Trifluoroacetic Acid SCHEMBL28697978 0.89 DPP4 (0.35) FAAHALDH1A1TSHRCES1CES2
Trifluoroacetic Acid SCHEMBL29019087 0.88 FUCA1 (0.39) FAAHALDH1A1TSHRCES1CES2
Trifluoroacetic Acid SCHEMBL5898930 0.88 FAAH (0.36) FAAHALDH1A1TSHRCES1CES2

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
CN-117471009-A Pretreatment method of biological sample and detection method of free amino acid 山西欧鼎科技有限公司 2024-01-30 CN claimed
CN-117471009-A Pretreatment method of biological sample and detection method of free amino acid 山西欧鼎科技有限公司 2024-01-30 CN disclosed
EP-1047438-B1 A PROCESS FOR THE ISOLATION, RECOVERY AND PURIFICATION OF NON-POLAR EXTRACTIVES CA MINISTER AGRICULTURE & FOOD (CA) 2004-09-08 EP disclosed
US-6495140-B1 SOLVENT EXTRACTION OF SYNTHETIC AND PLANT EXTRACTS, SEPARATING USING POLYSACCHARIDE GEL MATRICES, THEN REGENERATING THE GELS BY WASHING FOR REUSE HER MAJESTY IN RIGHT OF CANADA AS REPRESENTED BY THE MINISTER OF AGRICULTURE AND AGRI-FOOD CANADA (CA) 2002-12-17 US disclosed