Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL3375475

C[S+](C)c1cccc(N(c2ccccc2)c2ccc(C=Cc3ccc(N(c4ccccc4)c4cccc([S+](C)C)c4)cc3)cc2)c1.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.34

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
APP P05067 1/20 0.34
PTPN1 P18031 2/20 0.33
MAT2A P31153 1/20 0.33
KCNH2 Q12809 1/20 0.33
RORC P51449 1/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
PSMD14 O00487 1/20 0.32
APAF1 O14727 1/20 0.32
USP2 O75604 1/20 0.32
POLB P06746 1/20 0.32
MMP2 P08253 1/20 0.32
RAD52 P43351 1/20 0.32
CASP6 P55212 1/20 0.32
UBE2N P61088 1/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC8 Q9BY41 2/20 0.32
HDAC3 O15379 1/20 0.32

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 SCHEMBL3375471 0.91 NSD2 (0.35) RELACTDSP1APPPTPN1MAT2A
Trifluoromethanesulfonic Acid SCHEMBL3375473 0.91 NSD2 (0.35) RELACTDSP1APPPTPN1MAT2A
Trifluoromethanesulfonic Acid SCHEMBL4870182 0.87 HPGD (0.33) NPC1RAB9ATRPM8HPGDSMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL3370751 0.82 CYSLTR2 (0.33)
SCHEMBL4866277 0.81 RELA (0.36) RELACTDSP1APPPTPN1MAT2A
Trifluoromethanesulfonic Acid SCHEMBL3371612 0.81 GPR3 (0.36) PTPN1KCNH2RORCMEN1KMT2A
Trifluoromethanesulfonic Acid SCHEMBL4870192 0.79 KCNH2 (0.38) KCNH2HPGDSMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL4870169 0.79 KCNH2 (0.38) KCNH2HPGDSMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL3966822 0.74 PTPN1 (0.39) PTPN1MEN1KMT2ANR1H3MAPT
Trifluoromethanesulfonic Acid SCHEMBL1005212 0.74 ALDH1A1 (0.41) PTPN1RORCMEN1KMT2ANR1H3

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
EP-2236488-A1 Materials, methods and uses for photochemical generation of acids and/or radical species The Arizona Board of Regents on behalf of the University of Arizona (US) 2010-10-06 EP disclosed
US-7459106-B2 Materials, methods, and uses for photochemical generation of acids and/or radical species THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2008-12-02 US disclosed
US-20050173683-A1 Materials, methods, and uses for photochemical generation of acids and/or radical species THE ARIZ BD OF REGENTS ON BEHALF OF THE UNIV OF AZ (US) 2005-08-11 US disclosed