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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2995465

CC(c1cccnc1)n1c(-c2ccccc2)c(C2CCCCC2)c2sc(C(=O)O)cc21.O=C(O)C(F)(F)F

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.36
▸ DPP7 Q9UHL4 1/20 0.36
▸ ATM Q13315 2/20 0.34
▸ ADORA2B P29275 2/20 0.34
▸ MKNK1 Q9BUB5 1/20 0.33
▸ MKNK2 Q9HBH9 1/20 0.33
▸ F2 P00734 1/20 0.33
▸ PRSS1 P07477 1/20 0.33
▸ ADRB1 P08588 1/20 0.33
▸ ADRB3 P13945 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TLR9 Q9NR96 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP3A5 P20815 1/20 0.32
▸ RIPK1 Q13546 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
Trifluoroacetic Acid SCHEMBL2995589 0.81 GRIN1 (0.37) F2
Trifluoroacetic Acid SCHEMBL2995466 0.79 DRD2 (0.38) ATMF2
SCHEMBL5237385 0.75 KDM4E (0.40) —
SCHEMBL2997466 0.73 TP53 (0.39) —
Trifluoroacetic Acid SCHEMBL2992079 0.72 MEN1 (0.36) CYP3A4
SCHEMBL27642151 0.70 GRIN1 (0.35) —
SCHEMBL13211511 0.70 ALDH1A1 (0.37) CYP3A4
SCHEMBL13211510 0.69 FEN1 (0.39) SMN1; SMN2
SCHEMBL13211483 0.69 FABP4 (0.38) —
SCHEMBL13211536 0.69 PTGDR (0.36) CYP3A4

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
US-7781431-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2010-08-24 — — US claimed