Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7180418

N=C(N)c1ccc2cc(Oc3ccc(NS(=O)(=O)c4cccc(C(=O)O)c4)cc3-c3ccccc3C(=O)O)ccc2c1.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F2 P00734 13/20 0.49
TMPRSS6 Q8IU80 6/20 0.49
AKR1C3 P42330 1/20 0.48
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
F7 P08709 1/20 0.42
F3 P13726 1/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
ST14 Q9Y5Y6 1/20 0.42
F10 P00742 1/20 0.41

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
SCHEMBL6377229 0.95 AKR1C3 (0.52) F2TMPRSS6AKR1C3MEN1KMT2A
Trifluoroacetic Acid SCHEMBL7154584 0.93 F2 (0.44) F2TMPRSS6AKR1C3F3PRSS1
Trifluoroacetic Acid SCHEMBL6294978 0.90 F2 (0.49) F2TMPRSS6MEN1KMT2AF7
Trifluoroacetic Acid SCHEMBL7158713 0.90 F2 (0.48) F2TMPRSS6MEN1KMT2AF7
Trifluoroacetic Acid SCHEMBL7158686 0.89 F2 (0.45) F2TMPRSS6MEN1KMT2AF7
Trifluoroacetic Acid SCHEMBL7158329 0.89 PLA2G7 (0.42) F2TMPRSS6PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL7157714 0.89 PLA2G7 (0.42) F2TMPRSS6PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL7157101 0.89 PLA2G7 (0.44) F2TMPRSS6F7F3PRSS1
Trifluoroacetic Acid SCHEMBL7154640 0.88 PLA2G7 (0.46) F2TMPRSS6MEN1KMT2AF7
Trifluoroacetic Acid SCHEMBL7154045 0.88 PLA2G7 (0.43) F2TMPRSS6MEN1KMT2AF7

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