Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL28622894

NCC(F)CCF.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.34

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Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.32
GABBR1 Q9UBS5 1/20 0.32
CETP P11597 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
Sulfuric Acid SCHEMBL28635791 0.86 GABBR2 (0.37) GABBR2GABBR1
SCHEMBL5586206 0.78
Trifluoromethanesulfonic Acid SCHEMBL21753224 0.74 ALDH1A1 (0.36) CA1CA2CA7CA13ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL28056248 0.73 BLM (0.43) CA1CA2CA7CA13ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL8540103 0.72 ALDH1A1 (0.43) CA1CA2CA7CA13ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL165694 0.72 ALDH1A1 (0.43) CA1CA2CA7CA13ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL29199623 0.72 ALDH1A1 (0.43) CA1CA2CA7CA13ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL12506224 0.71 CA1 (0.40) CA1CA2CA7CA13ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL27888163 0.71 CA1 (0.40) CA1CA2CA7CA13ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL28292967 0.71 ALDH1A1 (0.38) CA1CA2CA7CA13ALDH1A1

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
CN-113252759-A Electrochemical gas sensor and electrolyte for electrochemical gas sensor 德尔格安全股份两合公司 2021-08-13 CN disclosed