Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7457544

Nc1nccc2c(CN3CCC(N)C3=O)csc12.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.35
HRH4 Q9H3N8 4/20 0.34
HRH3 Q9Y5N1 4/20 0.34
DPP4 P27487 8/20 0.32
DPP7 Q9UHL4 7/20 0.32
DPP8 Q6V1X1 6/20 0.31
DPP9 Q86TI2 6/20 0.31
CYP2D6 P10635 1/20 0.30
KCNH2 Q12809 1/20 0.30
F2 P00734 2/20 0.30
PRSS1 P07477 1/20 0.30
BTK Q06187 2/20 0.30
PLG P00747 1/20 0.30
PLAT P00750 1/20 0.30
PROC P04070 1/20 0.30

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 SCHEMBL7215793 1.00 F10 (0.35) F10HRH4HRH3DPP4DPP7
Trifluoroacetic Acid SCHEMBL7453281 0.90 HRH4 (0.34) F10HRH4HRH3DPP4DPP7
Trifluoroacetic Acid SCHEMBL7213617 0.90 HRH4 (0.34) F10HRH4HRH3DPP4DPP7
Trifluoroacetic Acid SCHEMBL7457541 0.89 F10 (0.33) F10HRH4HRH3F2PRSS1
Trifluoroacetic Acid SCHEMBL7215785 0.89 F10 (0.33) F10HRH4HRH3F2PRSS1
Trifluoroacetic Acid SCHEMBL7446703 0.85 KDR (0.36) F10HRH4HRH3DPP4DPP7
Trifluoroacetic Acid SCHEMBL7219133 0.85 KDR (0.36) F10HRH4HRH3DPP4DPP7
Trifluoroacetic Acid SCHEMBL7214366 0.83 CSF1R (0.31) F2
Trifluoroacetic Acid SCHEMBL6222163 0.80 F10 (0.49) F10HRH4HRH3DPP4DPP7
Trifluoroacetic Acid SCHEMBL7453374 0.80 F10 (0.49) F10HRH4HRH3DPP4DPP7

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-2001039759-A2 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-06-07 WO disclosed