Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL28956754

O=C(O)C(F)(F)F.O=C(O)CN1CC2CCC(C1)O2

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.38
HSD17B10 Q99714 1/20 0.35
WNT3A P56704 2/20 0.32
DPP8 Q6V1X1 2/20 0.31
DPP7 Q9UHL4 2/20 0.31
DPP4 P27487 1/20 0.31
PIK3R1 P27986 1/20 0.30
PIK3CA P42336 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 SCHEMBL28864675 0.91 HSD17B10 (0.36) HSD17B10
SCHEMBL29946293 0.89 PIK3CD (0.45) PIK3CDHSD17B10
SCHEMBL9208423 0.80 HSD17B10 (0.47) PIK3CDHSD17B10
Trifluoroacetic Acid SCHEMBL28864591 0.79 ALDH1A1 (0.45)
SCHEMBL29946381 0.79 HSD17B10 (0.43) PIK3CDHSD17B10
Trifluoroacetic Acid SCHEMBL28864651 0.77 HSD17B10 (0.40) HSD17B10
SCHEMBL28956751 0.76 PIK3CD (0.35) PIK3CDWNT3A
SCHEMBL20722035 0.70 HSD17B10 (0.38) HSD17B10
Trifluoroacetic Acid SCHEMBL6284934 0.69 HSD17B10 (0.74) HSD17B10
Trifluoroacetic Acid SCHEMBL7344714 0.68 GAA (0.47) HSD17B10

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-115244047-A Indazole derivative and application thereof in medicine 四川海思科制药有限公司 2022-10-25 CN disclosed