Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3676572

NC(=O)c1ccccc1-c1cnccn1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.43
ALOX5AP P20292 3/20 0.43
FEN1 P39748 3/20 0.43
CSNK1A1 P48729 1/20 0.43
TYRO3 Q06418 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
GRM5 P41594 1/20 0.42
NUDT1 P36639 1/20 0.41
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
TSHR P16473 1/20 0.38
MC4R P32245 1/20 0.38
ADRA1A P35348 1/20 0.38
MC3R P41968 1/20 0.38
METAP2 P50579 1/20 0.38

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
SCHEMBL30521876 0.90 BCAT2 (0.53) BCAT2ALOX5APFEN1CSNK1A1TYRO3
SCHEMBL45147 0.90 BCAT2 (0.53) BCAT2ALOX5APFEN1CSNK1A1TYRO3
SCHEMBL31227852 0.90 BCAT2 (0.53) BCAT2ALOX5APFEN1CSNK1A1TYRO3
Trifluoroacetic Acid SCHEMBL30607684 0.80 POLB (0.39) ALOX5APFEN1MEN1POLBKMT2A
SCHEMBL30776205 0.79 KDM4C (0.48) L3MBTL1KMT2ATSHRNPC1RAB9A
SCHEMBL28532968 0.79 KDM4C (0.48) L3MBTL1KMT2ATSHRNPC1RAB9A
SCHEMBL30776208 0.79 KDM4C (0.48) L3MBTL1KMT2ATSHRNPC1RAB9A
SCHEMBL30227102 0.79 KDM4C (0.48) L3MBTL1KMT2ATSHRNPC1RAB9A
SCHEMBL27870881 0.78 HCRTR2 (0.42) ALOX5APFEN1MEN1POLBKMT2A
Trifluoroacetic Acid SCHEMBL31255509 0.78 BCAT2 (0.79) BCAT2L3MBTL1ALOX5APFEN1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2170848-A1 PYRAZINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF LUNG DISEASES AstraZeneca AB (SE) 2010-04-07 EP disclosed
WO-2009001132-A1 PYRAZINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF LUNG DISEASES ASTRAZENECA AB (SE) 2008-12-31 WO disclosed