Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5204258

NC(=O)c1sc2c(c1-c1ccccn1)CCCC2.NCc1cccc(C(=O)N(CC(=O)O)c2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.34
FLT3 P36888 4/20 0.33
F2 P00734 4/20 0.33
PARP1 P09874 2/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
RORC P51449 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CPB2 Q96IY4 1/20 0.31
PKM P14618 1/20 0.31
FABP4 P15090 2/20 0.31
FABP5 Q01469 2/20 0.31
TPSAB1 Q15661 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 SCHEMBL5204591 0.91 F10 (0.33) F10FLT3F2PARP1
Trifluoroacetic Acid SCHEMBL5209196 0.90 IKBKB (0.33) F10FLT3F2PARP1RORC
Trifluoroacetic Acid SCHEMBL5209718 0.88 FLT3 (0.39) FLT3RORCNPC1RAB9A
Trifluoroacetic Acid SCHEMBL5211954 0.88 FLT3 (0.37) FLT3RORCNPC1RAB9A
Trifluoroacetic Acid SCHEMBL5206308 0.87 MEN1 (0.31) F10FLT3PARP1FABP4FABP5
Trifluoroacetic Acid SCHEMBL5208332 0.86 FLT3 (0.35) FLT3F2RORCNPC1RAB9A
Trifluoroacetic Acid SCHEMBL5209056 0.85 F2 (0.34) F10FLT3F2PRSS1PRSS2
Trifluoroacetic Acid SCHEMBL5204002 0.84 FLT3 (0.38) FLT3RORCNPC1RAB9A
Trifluoroacetic Acid SCHEMBL5280152 0.84 ALDH1A1 (0.40) FLT3RORCNPC1RAB9A
Trifluoroacetic Acid SCHEMBL5207943 0.84 KIF11 (0.44) FLT3PARP1RORCNPC1RAB9A

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