Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7654076

NC[C@H](NS(=O)(=O)c1cccs1)C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.54
SLC1A2 P43004 1/20 0.54
SLC1A1 P43005 1/20 0.54
TSHR P16473 2/20 0.50
ALDH1A1 P00352 5/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TP53 P04637 2/20 0.47
ITGB3 P05106 2/20 0.47
ITGA2B P08514 2/20 0.47
MAPT P10636 3/20 0.46
THRB P10828 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
USP2 O75604 1/20 0.44
GLA P06280 1/20 0.44
PKM P14618 1/20 0.44
HSD17B10 Q99714 1/20 0.44
BACE1 P56817 1/20 0.44
CYP2D6 P10635 1/20 0.42

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
SCHEMBL2735619 0.79 TSHR (0.70) SLC1A3SLC1A2SLC1A1TSHRALDH1A1
SCHEMBL6589504 0.78 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1TSHRALDH1A1
Trifluoroacetic Acid SCHEMBL7649357 0.77 MMP2 (0.65) SLC1A3SLC1A2SLC1A1
SCHEMBL7062972 0.76 SLC1A3 (0.56) SLC1A3SLC1A2SLC1A1TSHRALDH1A1
Trifluoroacetic Acid SCHEMBL7653125 0.75 SLC1A3 (0.53) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT
Trifluoroacetic Acid SCHEMBL2655268 0.73 F2 (0.45) SLC1A3SLC1A2SLC1A1TSHRALDH1A1
Trifluoroacetic Acid SCHEMBL7656969 0.73 SLC1A3 (0.62) SLC1A3SLC1A2ITGB3ITGA2BKMT2A
SCHEMBL8087637 0.72 L3MBTL1 (0.65) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT
SCHEMBL30856551 0.71 SLC1A3 (0.62) SLC1A3SLC1A2SLC1A1TSHRALDH1A1
SCHEMBL6500230 0.70 MMP2 (0.61) SLC1A3SLC1A2SLC1A1ALDH1A1ITGB3

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-6335337-B1 ANTICOAGULANTS LABORATOIRE L. LAFON (FR) 2002-01-01 US disclosed