Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL7048346

Cc1cc(F)ccc1OC(=O)c1c2ccccc2[n+](CC(=O)O)c2ccccc12.O=S(=O)([O-])C(F)(F)F

nearest known ligand 0.34

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PTGDR2 Q9Y5Y4 5/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
PTPN1 P18031 1/20 0.34
KEAP1 Q14145 3/20 0.32
NFE2L2 Q16236 3/20 0.32
PTGDR Q13258 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ACHE P22303 2/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
TAS2R14 Q9NYV8 1/20 0.31

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
Trifluoromethanesulfonic Acid SCHEMBL7047547 0.91 MEN1 (0.35) L3MBTL1MAPTCYP1A2CYP2C9CYP2C19
Trifluoromethanesulfonic Acid SCHEMBL7051082 0.83 KMT2A (0.45) MAPTCYP1A2CYP2C9KDM4ETSHR
Trifluoromethanesulfonic Acid SCHEMBL7049408 0.82 MAPT (0.34) NPSR1MAPTPTGDR2MRGPRX4PTPN1
Trifluoromethanesulfonic Acid SCHEMBL7046743 0.82 MEN1 (0.33) MAPTPTPN1KDM4E
Trifluoromethanesulfonic Acid SCHEMBL7044721 0.81 KMT2A (0.38) NPSR1MAPTKEAP1NFE2L2
Trifluoromethanesulfonic Acid SCHEMBL7049432 0.81 NPC1 (0.33) MAPTCYP2C19KDM4E
Trifluoromethanesulfonic Acid SCHEMBL7049675 0.81
Trifluoromethanesulfonic Acid SCHEMBL7048911 0.81 TP53 (0.37) NPSR1L3MBTL1MAPTCYP1A2CYP3A4
Trifluoromethanesulfonic Acid SCHEMBL7049568 0.80 KMT2A (0.36) PTGDR2KDM4EACHEFFAR4
Trifluoromethanesulfonic Acid SCHEMBL8875515 0.80 MAPT (0.37) NPSR1MAPTCYP3A4CYP2C9CYP2C19

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
EP-0609885-B1 Acridinium compounds and conjugates thereof MOCHIDA PHARM CO LTD (JP) 2003-04-16 EP disclosed
US-5594112-A CHEMILUMINESCENCE LABEL MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1997-01-14 US disclosed
US-5438139-A Chemiluminescent; useful as immunolochemical, DNA probe and receptor bininding assays MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-08-01 US disclosed
EP-0609885-A1 Acridinium compounds and conjugates thereof MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1994-08-10 EP disclosed