Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL28252550

CCCC/C=C\CCCCCCCCCC.O=C(O)C(F)(F)F

nearest known ligand 0.68

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.68
CES1 P23141 2/20 0.68
TERT O14746 3/20 0.60
PTPN1 P18031 3/20 0.60
PPARG P37231 3/20 0.60
PPARD Q03181 3/20 0.60
PPARA Q07869 3/20 0.60
MAPT P10636 3/20 0.60
BLM P54132 3/20 0.60
TOP1 P11387 3/20 0.60
HSD17B10 Q99714 2/20 0.60
FABP4 P15090 2/20 0.60
F7 P08709 2/20 0.60
F3 P13726 2/20 0.60
GMNN O75496 1/20 0.60
USP2 O75604 1/20 0.60
LMNA P02545 1/20 0.60
CYP1A2 P05177 1/20 0.60
POLB P06746 1/20 0.60
CYP2C9 P11712 1/20 0.60

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 SCHEMBL28252551 1.00 FAAH (0.68) FAAHCES1TERTPTPN1PPARG
Trifluoroacetic Acid SCHEMBL28474921 1.00 FAAH (0.68) FAAHCES1TERTPTPN1PPARG
SCHEMBL28492683 0.89 FAAH (0.59) FAAHCES1TERTPTPN1PPARG
Trifluoroacetic Acid SCHEMBL29674884 0.89 FAAH (0.59) FAAHCES1TERTPTPN1PPARG
Trifluoroacetic Acid SCHEMBL30503605 0.88 FAAH (0.53) FAAHCES1TERTPTPN1PPARG
SCHEMBL28469797 0.87 FAAH (0.57) FAAHCES1TERTPTPN1PPARG
Trifluoroacetic Acid SCHEMBL8566194 0.87 FAAH (0.57) FAAHCES1TERTPTPN1PPARG
Trifluoroacetic Acid SCHEMBL8566195 0.87 FAAH (0.57) FAAHCES1TERTPTPN1PPARG
Trifluoroacetic Acid SCHEMBL30268920 0.86 FAAH (0.61) FAAHCES1TERTPTPN1PPARG
Heptane SCHEMBL3935940 0.85 FAAH (0.62) FAAHCES1PTPN1PPARGPPARD

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
CN-108812664-A A kind of footpath between fields noctuid lure composition and application thereof 中国农业科学院植物保护研究所 2018-11-16 CN claimed
CN-108812664-A A kind of footpath between fields noctuid lure composition and application thereof 中国农业科学院植物保护研究所 2018-11-16 CN disclosed
CN-108812664-A A kind of footpath between fields noctuid lure composition and application thereof 中国农业科学院植物保护研究所 2018-11-16 CN disclosed