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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9083554

CCCC[C@H]1CN(C(=O)c2cccc3ccccc23)CCN1C(Cc1cccc2ccccc12)c1cnc[nH]1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 16/20 0.58
▸ FNTB P49356 15/20 0.58
▸ PGGT1B P53609 1/20 0.38
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL3501329 0.95 FNTA (0.64) FNTAFNTBPGGT1BMEN1KMT2A
Trifluoroacetic Acid SCHEMBL8454195 0.91 FNTA (0.57) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL8455766 0.91 FNTA (0.57) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL8456093 0.91 FNTA (0.57) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL8452329 0.91 FNTA (0.58) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL8452331 0.91 FNTA (0.56) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL8452838 0.91 FNTA (0.56) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL8454005 0.91 FNTA (0.56) FNTAFNTBPGGT1BMEN1KMT2A
Trifluoroacetic Acid SCHEMBL8452831 0.90 FNTA (0.55) FNTAFNTBPGGT1BMEN1KMT2A
Trifluoroacetic Acid SCHEMBL9080706 0.90 FNTA (0.55) FNTAFNTBPGGT1BMEN1KMT2A

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-1996030343-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-03 — — WO disclosed