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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1874802

Cc1cc(Oc2ccc3[nH]cnc3c2)ccc1CNC1CCC(C)(C)CC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.32
▸ PPARD Q03181 2/20 0.32
▸ PPARA Q07869 2/20 0.32
▸ SCN9A Q15858 2/20 0.32
▸ P2RY14 Q15391 2/20 0.31
▸ BTK Q06187 1/20 0.31
▸ FGFR4 P22455 3/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ SRC P12931 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
Trifluoroacetic Acid SCHEMBL1874258 0.91 BTK (0.37) PPARGPPARASCN9ABTK
Trifluoroacetic Acid SCHEMBL1878705 0.89 CCR2 (0.37) BTK
Trifluoroacetic Acid SCHEMBL1876380 0.86 QPCT (0.34) PPARGPPARDPPARA
Trifluoroacetic Acid SCHEMBL1871067 0.86 SLC2A1 (0.37) PPARGPPARDPPARA
SCHEMBL12634134 0.84 MMP12 (0.41) P2RY14
Trifluoroacetic Acid SCHEMBL1877301 0.83 GHSR (0.37) —
Trifluoroacetic Acid SCHEMBL1875571 0.82 PPARA (0.38) PPARGPPARDPPARABTK
Trifluoroacetic Acid SCHEMBL1879078 0.81 SCN9A (0.41) SCN9A
Trifluoroacetic Acid SCHEMBL1877914 0.79 PTPN2 (0.38) —
Trifluoroacetic Acid SCHEMBL1876615 0.79 PTPN2 (0.38) —

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-7939528-B2 Heterocycle compounds GLAXOSMITHKLINE LLC (US) 2011-05-10 — — US disclosed