Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6584844

Cn1cc(-c2n[nH]c(=O)n2-c2cn(CCCN)c3ccc(F)cc23)c2c(F)cccc21.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 4/20 0.37
PIM1 P11309 1/20 0.37
HSP90AA1 P07900 7/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.34
PLK1 P53350 1/20 0.34
TPSAB1 Q15661 2/20 0.33
ICMT O60725 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
HTR6 P50406 1/20 0.33

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 SCHEMBL6585782 0.92 CAMK2D (0.45) CAMK2DPIM1HSP90AA1PTGDR2
Trifluoroacetic Acid SCHEMBL6588330 0.90 CAMK2D (0.43) CAMK2DPIM1HSP90AA1PTGDR2PLK1
SCHEMBL6588558 0.89 ICMT (0.39) CAMK2DPIM1HSP90AA1ICMTCNR1
Trifluoroacetic Acid SCHEMBL6591980 0.89 ICMT (0.37) CAMK2DPIM1HSP90AA1PTGDR2PLK1
Trifluoroacetic Acid SCHEMBL6588928 0.89 HSP90AA1 (0.34) HSP90AA1PTGDR2
Trifluoroacetic Acid SCHEMBL6588931 0.89 HSP90AA1 (0.34) HSP90AA1PTGDR2
Trifluoroacetic Acid SCHEMBL6586877 0.88 ICMT (0.38) CAMK2DPIM1HSP90AA1PTGDR2PLK1
Trifluoroacetic Acid SCHEMBL6590147 0.87 HSP90AA1 (0.38) CAMK2DPIM1HSP90AA1PTGDR2PLK1
Trifluoroacetic Acid SCHEMBL6590532 0.87 CDK2 (0.38) CAMK2DPIM1HSP90AA1PTGDR2PLK1
Trifluoroacetic Acid SCHEMBL6586732 0.87 PTGDR2 (0.37) CAMK2DPIM1HSP90AA1PTGDR2PLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1183252-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS ASTRAZENECA AB (SE) 2004-02-18 EP disclosed
US-6492406-B1 PROTEIN KINASE C INHIBITORS; ANTIINFLAMMATORY AND IMMUNO-SUPPRESSIVE AGENTS ASTRAZENECA AB (SE) 2002-12-10 US disclosed
EP-1183252-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS AstraZeneca AB (SE) 2002-03-06 EP disclosed
WO-2000071537-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS ASTRAZENECA AB (SE) 2000-11-30 WO disclosed