Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL28686999

O=C(O)C(F)(F)F.Oc1ccc(-c2cc(OCC3CNC3)c3cn[nH]c3c2)cc1F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 9/20 0.46
JAK2 O60674 7/20 0.46
JAK1 P23458 7/20 0.46
TYK2 P29597 7/20 0.46
FGFR1 P11362 2/20 0.43
FGFR2 P21802 1/20 0.43
FFAR4 Q5NUL3 1/20 0.37
SYK P43405 2/20 0.36
PIK3CD O00329 3/20 0.36
PIM1 P11309 3/20 0.36
PIK3CA P42336 3/20 0.36
GSK3B P49841 3/20 0.36
PIK3CB P42338 2/20 0.36
SGK1 O00141 1/20 0.36
PIK3CG P48736 2/20 0.35
MIF P14174 1/20 0.34
RAF1 P04049 1/20 0.34
BRAF P15056 1/20 0.34

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
SCHEMBL20699403 0.93 JAK3 (0.49) JAK3JAK2JAK1TYK2FGFR1
SCHEMBL30161719 0.93 JAK3 (0.49) JAK3JAK2JAK1TYK2FGFR1
Trifluoroacetic Acid SCHEMBL28680413 0.89 PIK3CD (0.45) JAK3JAK2JAK1TYK2FGFR1
Trifluoroacetic Acid SCHEMBL29608317 0.89 PIK3CD (0.45) JAK3JAK2JAK1TYK2FGFR1
Trifluoroacetic Acid SCHEMBL28687582 0.85 FGFR1 (0.42) JAK3JAK2JAK1TYK2FGFR1
Trifluoroacetic Acid SCHEMBL28689763 0.84 JAK3 (0.52) JAK3JAK2JAK1TYK2
Trifluoroacetic Acid SCHEMBL28681300 0.83 PIM1 (0.35) JAK3JAK2JAK1TYK2PIK3CD
Trifluoroacetic Acid SCHEMBL28686997 0.81 JAK3 (0.47) JAK3JAK2JAK1TYK2FGFR1
Trifluoroacetic Acid SCHEMBL29607193 0.80 JAK2 (0.43) JAK3JAK2JAK1TYK2FGFR1
SCHEMBL20699367 0.80 PIK3CD (0.47) JAK3JAK2JAK1TYK2FGFR1

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
CN-113831326-A Condensed heterocyclic derivative and application thereof in medicine 四川海思科制药有限公司 2021-12-24 CN disclosed