Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5208294

CS(=O)(=O)c1c(C(N)=O)sc2c1CCCC2.Cc1cccc(N(CC(=O)O)C(=O)c2cccc(CN)c2)n1.O=C(O)C(F)(F)F

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RORC P51449 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
FLT3 P36888 1/20 0.30

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 SCHEMBL5211197 0.90 FLT3 (0.36) MEN1POLBKMT2ANPSR1RORC
Trifluoroacetic Acid SCHEMBL5209056 0.89 F2 (0.34) MEN1POLBKMT2ANPSR1RORC
Trifluoroacetic Acid SCHEMBL5208796 0.88 SMN1; SMN2 (0.35) MEN1POLBKMT2A
Trifluoroacetic Acid SCHEMBL5209115 0.88 ENPP2 (0.34) OPRM1OPRD1
Trifluoroacetic Acid SCHEMBL5209196 0.87 IKBKB (0.33) NPSR1RORCFLT3
Trifluoroacetic Acid SCHEMBL5209741 0.86 PDE4D (0.38) NPSR1
Trifluoroacetic Acid SCHEMBL5209006 0.85 PIK3CA (0.33) MEN1POLBKMT2ANPSR1OPRM1
Trifluoroacetic Acid SCHEMBL5208291 0.83 MAPT (0.33)
Trifluoroacetic Acid SCHEMBL5206929 0.78 NPSR1 (0.34) MEN1POLBKMT2ANPSR1RORC
Trifluoroacetic Acid SCHEMBL5209718 0.77 FLT3 (0.39) MEN1POLBKMT2ANPSR1RORC

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
EP-1343561-B1 SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2007-02-28 EP disclosed