Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6824549

N#C[C@@H]1CCCCN1C(=O)C(N)CCN.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.83

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 9/20 0.83
DPP4 P27487 17/20 0.72
DPP8 Q6V1X1 16/20 0.72
DPP9 Q86TI2 2/20 0.65
FAP Q12884 1/20 0.56

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 SCHEMBL6820670 0.92 DPP4 (0.84) DPP7DPP4DPP8DPP9FAP
SCHEMBL6824504 0.91 DPP7 (1.00) DPP7DPP4DPP8DPP9FAP
SCHEMBL6824505 0.91 DPP7 (1.00) DPP7DPP4DPP8DPP9FAP
Trifluoroacetic Acid SCHEMBL6824122 0.88 DPP4 (0.84) DPP7DPP4DPP8DPP9FAP
SCHEMBL6826607 0.83 DPP4 (1.00) DPP7DPP4DPP8DPP9FAP
Trifluoroacetic Acid SCHEMBL5649111 0.81 DPP4 (0.66) DPP7DPP4DPP8DPP9FAP
Trifluoroacetic Acid SCHEMBL2400454 0.80 DPP4 (0.77) DPP7DPP4DPP8
Trifluoroacetic Acid SCHEMBL3403495 0.80 DPP4 (0.77) DPP7DPP4DPP8
Trifluoroacetic Acid SCHEMBL2398411 0.79 DPP4 (0.79) DPP7DPP4DPP8
Trifluoroacetic Acid SCHEMBL5651865 0.79 DPP4 (0.63) DPP7DPP4DPP8DPP9FAP

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
WO-2004076433-A1 DIPEPTIDYL PEPTIDASE INHIBITORS AIC (BE) 2004-09-10 WO disclosed