Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30201522

Cn1ccnc1CN1C2CCC1CC(N)C2.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.37
ARG2 P78540 1/20 0.37
FDPS P14324 1/20 0.35
PTPN11 Q06124 1/20 0.35
HRH4 Q9H3N8 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
OPRK1 P41145 2/20 0.33
KCNH2 Q12809 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
OPRM1 P35372 2/20 0.32
OPRD1 P41143 2/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
MLYCD O95822 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 SCHEMBL31622406 1.00 ARG1 (0.37) ARG1ARG2FDPSPTPN11HRH4
SCHEMBL30833221 0.88 PTPN11 (0.40) ARG1ARG2FDPSPTPN11MEN1
Trifluoroacetic Acid SCHEMBL30201435 0.76 LTA4H (0.49) ARG1ARG2MEN1KMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL30201500 0.75 CYP3A4 (0.39) ARG1ARG2HRH4HRH3ALDH1A1
Trifluoroacetic Acid SCHEMBL30201424 0.75 OPRM1 (0.52) ALDH1A1OPRK1KCNH2L3MBTL1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL30201490 0.75 ARG1 (0.35) ARG1ARG2HRH4HRH3OPRK1
Trifluoroacetic Acid SCHEMBL30201532 0.75 DPP4 (0.41) HRH4HRH3OPRK1KCNH2OPRM1
Trifluoroacetic Acid SCHEMBL16700919 0.72 FDPS (0.46) FDPSHRH4HRH3MEN1KMT2A
Trifluoroacetic Acid SCHEMBL30201455 0.72 ARG1 (0.54) ARG1ARG2MEN1KMT2AMAPK1
Trifluoroacetic Acid SCHEMBL30201437 0.72 ARG1 (0.54) ARG1ARG2MEN1KMT2AMAPK1

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-2023009330-A1 SEROTONIN 5-HT2B INHIBITORY COMPOUNDS ZOETIS SERVICES LLC (US) 2023-02-02 WO disclosed