Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8613845

CSCC[C@H](NC(=O)c1nccc2ccccc12)C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
FNTA P49354 4/20 0.45
FNTB P49356 4/20 0.45
RAB9A P51151 1/20 0.45
ITGB1 P05556 1/20 0.44
ITGA4 P13612 1/20 0.44
ALDH1A1 P00352 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CCR1 P32246 1/20 0.44

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 SCHEMBL8613841 1.00 MEN1 (0.47) MEN1KMT2AFNTAFNTBRAB9A
SCHEMBL7837437 0.95 KMT2A (0.51) MEN1KMT2AFNTAFNTBRAB9A
SCHEMBL7837444 0.95 KMT2A (0.51) MEN1KMT2AFNTAFNTBRAB9A
SCHEMBL7848067 0.84 KMT2A (0.60) KMT2AFNTAFNTBRAB9A
SCHEMBL8790433 0.84 KMT2A (0.60) KMT2AFNTAFNTBRAB9A
SCHEMBL9828951 0.76 FNTA (0.62) MEN1KMT2AFNTAFNTBALDH1A1
SCHEMBL2324069 0.76 FNTA (0.62) MEN1KMT2AFNTAFNTBALDH1A1
SCHEMBL13018869 0.76 RAB9A (0.43) MEN1KMT2ARAB9AITGB1ITGA4
SCHEMBL7335664 0.75 RAB9A (0.52) RAB9AITGB1ITGA4ALDH1A1CCR1
SCHEMBL27974453 0.75 FNTA (0.49) MEN1KMT2AFNTAFNTBALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0837857-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 1998-08-05 EP disclosed
EP-0837857-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-04-29 EP disclosed
WO-1996031525-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-10 WO disclosed