Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7153927

COc1ccc(S(=O)(=O)Nc2ccc(Oc3ccc4cc(C(=N)N)ccc4c3)c(C(=O)O)c2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.49

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Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2 P00734 7/20 0.49
F3 P13726 7/20 0.49
ALDH1A1 P00352 1/20 0.46
F10 P00742 2/20 0.46
F7 P08709 2/20 0.46
POLB P06746 1/20 0.45
PLA2G7 Q13093 2/20 0.45
FFAR4 Q5NUL3 1/20 0.44
PPARG P37231 1/20 0.44
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
ST14 Q9Y5Y6 1/20 0.43
PLAU P00749 1/20 0.43

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 SCHEMBL7153324 0.93 F2 (0.48) F2F3ALDH1A1POLBPLA2G7
Trifluoroacetic Acid SCHEMBL7151889 0.93 F2 (0.51) F2F3ALDH1A1POLBPLA2G7
Trifluoroacetic Acid SCHEMBL7158701 0.92 F2 (0.53) F2F3ALDH1A1F10F7
Trifluoroacetic Acid SCHEMBL7154700 0.92 ALDH1A1 (0.58) F2F3ALDH1A1F10F7
Trifluoroacetic Acid SCHEMBL7150780 0.90 PRSS1 (0.55) F2F3ALDH1A1F10F7
Trifluoroacetic Acid SCHEMBL7158686 0.90 F2 (0.45) F2F3ALDH1A1F10F7
Trifluoroacetic Acid SCHEMBL7154778 0.89 PLA2G7 (0.46) F2F3ALDH1A1F10F7
Trifluoroacetic Acid SCHEMBL6300672 0.88 F10 (0.48) F2F3F10F7
Trifluoroacetic Acid SCHEMBL7153799 0.86 ALDH1A1 (0.51) F2F3ALDH1A1F10F7
Trifluoroacetic Acid SCHEMBL7154050 0.85 F2 (0.53) F2ALDH1A1F10PLA2G7FFAR4

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
EP-1312602-A1 Amidino derivatives, and anticoagulants and thrombosis therapeutic agents containing them Eisai Co., Ltd. (JP) 2003-05-21 EP disclosed