Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8906248

CN(C)[C@H]1CC[C@H](CN)CC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.44
PLAT P00750 1/20 0.44
LMNA P02545 1/20 0.44
CYP2D6 P10635 1/20 0.34
HTR5A P47898 1/20 0.34
F11 P03951 5/20 0.34
KLKB1 P03952 5/20 0.34
CHRM3 P20309 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
DPP8 Q6V1X1 2/20 0.33
DPP7 Q9UHL4 2/20 0.33
F2 P00734 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31
HSD11B1 P28845 2/20 0.31
DPP4 P27487 1/20 0.31
NCF1 P14598 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
SCHEMBL6654835 0.81 NCF1 (0.42) PLGPLATLMNANCF1
SCHEMBL8899930 0.81 NCF1 (0.42) PLGPLATLMNANCF1
Trifluoroacetic Acid SCHEMBL1958022 0.76 PLG (0.40) PLGPLATLMNACYP2D6F11
Trifluoroacetic Acid SCHEMBL7707560 0.76 ALDH1A1 (0.40) HRH4HRH3HSD11B1
SCHEMBL22835510 0.74 PLG (0.50) PLGPLATLMNACYP2D6F2
SCHEMBL3847317 0.74 PLG (0.50) PLGPLATLMNACYP2D6F2
SCHEMBL2985536 0.74 PLG (0.50) PLGPLATLMNACYP2D6F2
Trifluoroacetic Acid SCHEMBL8901689 0.73 PLG (0.42) PLGPLATLMNACYP2D6F11
Trifluoroacetic Acid SCHEMBL8916303 0.73 PLG (0.42) PLGPLATLMNACYP2D6F11
Trifluoroacetic Acid SCHEMBL3377548 0.73 PLG (0.44) PLGPLATLMNACYP2D6F11

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-1997020823-A2 2-AMINO QUINAZOLINE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 1997-06-12 WO disclosed