Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8869802

Cc1cccc(/C=C/c2cccc(NC[C@@H](N)CS)c2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.53

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Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.49
FNTB P49356 10/20 0.49
PGGT1B P53609 6/20 0.43

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 SCHEMBL8869811 1.00 FNTA (0.49) FNTAFNTBPGGT1B
SCHEMBL7996917 0.89 FNTA (0.60) FNTAFNTBPGGT1B
SCHEMBL7996915 0.89 FNTA (0.60) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL7996549 0.77 FNTA (0.54) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL7996546 0.77 FNTA (0.54) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL7997330 0.76 MEN1 (0.49) FNTAFNTB
Trifluoroacetic Acid SCHEMBL8869572 0.72 FNTA (0.53) FNTAFNTBPGGT1B
SCHEMBL7994646 0.69 FNTA (0.60) FNTAFNTBPGGT1B
SCHEMBL8934697 0.69 FNTA (0.56) FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL7998320 0.69 FNTA (0.59) FNTAFNTBPGGT1B

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
US-5631280-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1997-05-20 US disclosed