Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5205740

CC(C)CNC(=O)c1c(C(N)=O)sc2c1CCCC2.NCc1cccc(C(=O)N(CC(=O)O)c2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.38
KMT2A Q03164 6/20 0.38
FLT3 P36888 5/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
KIF11 P52732 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36
MEN1 O00255 5/20 0.35
CASP3 P42574 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
MAPT P10636 3/20 0.35
POLB P06746 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MGAM O43451 2/20 0.35
AMY1A P0DUB6 1/20 0.35
ALDH1A1 P00352 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NOD1 Q9Y239 1/20 0.34

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 SCHEMBL5207372 0.92 RORC (0.47) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5204002 0.91 FLT3 (0.38) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5209718 0.89 FLT3 (0.39) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5205660 0.89 RORC (0.38) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5211954 0.89 FLT3 (0.37) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5280152 0.88 ALDH1A1 (0.40) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5208332 0.88 FLT3 (0.35) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5210994 0.87 MAPT (0.43) RORCKMT2ARAB9AMEN1MAPT
Trifluoroacetic Acid SCHEMBL5204823 0.87 AMY1A (0.48) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5628234 0.87 ALDH1A1 (0.38) RORCKMT2AFLT3NPC1RAB9A

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