Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3239147

CCCNC(=O)N1CC2CCC1CNC2.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.38
CHRNB4 P30926 3/20 0.38
CHRNA3 P32297 3/20 0.38
CHRNA7 P36544 3/20 0.38
CHRNA4 P43681 3/20 0.38
LMNA P02545 1/20 0.34
SOST Q9BQB4 1/20 0.34
FUCA1 P04066 1/20 0.33
CHRM3 P20309 1/20 0.32
CYP2C19 P33261 1/20 0.31
GAA P10253 1/20 0.31
KDM4C Q9H3R0 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
SCHEMBL3233238 0.91 CHRNB2 (0.44) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL3241059 0.83 L3MBTL1 (0.39) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
Trifluoroacetic Acid SCHEMBL3237253 0.82 CHRNB2 (0.47) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL3232278 0.81 CHRNB2 (0.42) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL3239698 0.77 LMNA (0.37) LMNASOSTCYP2C19GAA
SCHEMBL3231502 0.74 CHRNB2 (0.39) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
Trifluoroacetic Acid SCHEMBL3228620 0.73 CHRNB2 (0.30) CHRNB2CHRNA4
SCHEMBL3231814 0.73 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL3235805 0.71 CHRNB2 (0.56) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL25355436 0.70 CHRNB2 (0.38) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4

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-2010028011-A1 AMIDES OF DIAZABICYCLONONANES AND USES THEREOF TARGACEPT, INC. (US) 2010-03-11 WO disclosed