Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7153347

N=C(N)c1cccc(Oc2ccc(NS(=O)(=O)c3cc(S(=O)(=O)c4ccccc4)cs3)cc2C(=O)O)c1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F3 P13726 17/20 0.47
F10 P00742 3/20 0.47
F7 P08709 3/20 0.47
F2 P00734 11/20 0.45
TMPRSS6 Q8IU80 1/20 0.42

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 SCHEMBL7152683 0.92 F3 (0.43) F3F10F7F2TMPRSS6
Trifluoroacetic Acid SCHEMBL7153131 0.92 F3 (0.40) F3F10F7F2TMPRSS6
SCHEMBL7153348 0.90 F10 (0.42) F3F10F7F2TMPRSS6
Trifluoroacetic Acid SCHEMBL7154058 0.90 F3 (0.40) F3F10F7F2TMPRSS6
SCHEMBL7152685 0.83 F2 (0.37) F3F10F7F2TMPRSS6
Trifluoroacetic Acid SCHEMBL7154637 0.83 F2 (0.40) F3F10F7F2TMPRSS6
SCHEMBL7153138 0.82 PRSS1 (0.38) F10F2TMPRSS6
Trifluoroacetic Acid SCHEMBL7155335 0.82 F2 (0.56) F3F10F7F2TMPRSS6
Trifluoroacetic Acid SCHEMBL7157181 0.82 F3 (0.50) F3F10F7F2
Trifluoroacetic Acid SCHEMBL7154700 0.81 ALDH1A1 (0.58) F3F10F7F2

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