Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5658947

O=C(NCc1ccccc1C(F)(F)F)c1cc(-c2ccncc2)n[nH]c1=O.O=C(O)C(F)(F)F

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.61
MAPK13 O15264 1/20 0.58
MAPK12 P53778 1/20 0.58
MAPK11 Q15759 1/20 0.58
MAPK14 Q16539 1/20 0.58
CYP2C9 P11712 1/20 0.46
GRK3 P35626 2/20 0.46
ROCK2 O75116 2/20 0.46
PRKCA P17252 2/20 0.46
GRK2 P25098 2/20 0.46
PRKD3 O94806 1/20 0.46
PRKCG P05129 1/20 0.46
PRKCB P05771 1/20 0.46
PRKCH P24723 1/20 0.46
GRK5 P34947 1/20 0.46
PRKCI P41743 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKCQ Q04759 1/20 0.46
PRKCZ Q05513 1/20 0.46
PRKCD Q05655 1/20 0.46

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
SCHEMBL4854813 0.96 GSK3B (0.66) GSK3BMAPK13MAPK12MAPK11MAPK14
Trifluoroacetic Acid SCHEMBL5658531 0.89 GSK3B (0.61) GSK3BMAPK13MAPK12MAPK11MAPK14
Trifluoroacetic Acid SCHEMBL5660802 0.86 GSK3B (0.61) GSK3BMAPK13MAPK12MAPK11MAPK14
Trifluoroacetic Acid SCHEMBL5657169 0.86 GSK3B (0.61) GSK3BMAPK13MAPK12MAPK11MAPK14
Trifluoroacetic Acid SCHEMBL5657401 0.85 GSK3B (0.59) GSK3BMAPK13MAPK12MAPK11MAPK14
SCHEMBL14348309 0.84 GSK3B (0.66) GSK3BMAPK13MAPK12MAPK11MAPK14
Trifluoroacetic Acid SCHEMBL5655822 0.83 GSK3B (0.59) GSK3BROCK2PRKCAGRK2CASP1
Trifluoroacetic Acid SCHEMBL5659784 0.83 GSK3B (0.89) GSK3BMAPK13MAPK12MAPK11MAPK14
Trifluoroacetic Acid SCHEMBL5657745 0.82 GSK3B (0.55) GSK3BROCK2PRKCAGRK2KMT2A
Trifluoroacetic Acid SCHEMBL5659289 0.82 GSK3B (0.63) GSK3BMAPK13MAPK12MAPK11MAPK14

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-7309701-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-12-18 US disclosed