Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8041708

CC(C)CC(=O)N1CCc2ccc(C(N)=O)cc21.NCc1cccc(N(CC(=O)O)C(=O)c2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.37
OPRM1 P35372 12/20 0.35
OPRD1 P41143 12/20 0.35
OPRK1 P41145 2/20 0.34
TPSAB1 Q15661 3/20 0.34
ROCK1 Q13464 1/20 0.34
ALDH1A1 P00352 1/20 0.33

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 SCHEMBL5211360 0.96 RIPK1 (0.37) RIPK1OPRM1OPRD1OPRK1TPSAB1
Trifluoroacetic Acid SCHEMBL6489279 0.89 RIPK1 (0.35) RIPK1OPRM1OPRD1OPRK1TPSAB1
Trifluoroacetic Acid SCHEMBL7425564 0.89 RIPK1 (0.36) RIPK1OPRM1OPRD1OPRK1TPSAB1
Trifluoroacetic Acid SCHEMBL5629844 0.88 OPRM1 (0.34) RIPK1OPRM1OPRD1OPRK1TPSAB1
Trifluoroacetic Acid SCHEMBL7433118 0.88 RIPK1 (0.39) RIPK1TPSAB1ROCK1ALDH1A1
Trifluoroacetic Acid SCHEMBL7430442 0.88 RIPK1 (0.38) RIPK1OPRM1OPRD1OPRK1ROCK1
Trifluoroacetic Acid SCHEMBL5211441 0.87 RIPK1 (0.38) RIPK1OPRM1OPRD1OPRK1TPSAB1
Trifluoroacetic Acid SCHEMBL7421783 0.87 OPRM1 (0.34) RIPK1OPRM1OPRD1OPRK1TPSAB1
Trifluoroacetic Acid SCHEMBL5208180 0.87 RIPK1 (0.42) RIPK1ROCK1ALDH1A1
Trifluoroacetic Acid SCHEMBL5212450 0.87 RIPK1 (0.39) RIPK1OPRM1OPRD1OPRK1TPSAB1

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-2000077027-A2 SERINE PROTEASE INHIBITORS TULARIK LIMITED (GB) 2000-12-21 WO disclosed