Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6996192

CCC1CCc2sc(C(N)=O)nc2C1.NCc1cccc(N(CC(=O)O)C(=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 17)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 2/20 0.34
HRH1 P35367 2/20 0.34
HRH4 Q9H3N8 2/20 0.34
HRH3 Q9Y5N1 2/20 0.34
OPRD1 P41143 6/20 0.34
OPRM1 P35372 5/20 0.34
OPRK1 P41145 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PKM P14618 1/20 0.33
ACHE P22303 1/20 0.32
TPSAB1 Q15661 2/20 0.32
MAPT P10636 1/20 0.32
TNIK Q9UKE5 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31

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 SCHEMBL5206361 0.96 HRH2 (0.34) HRH2HRH1HRH4HRH3OPRD1
Trifluoroacetic Acid SCHEMBL6993355 0.91 OPRM1 (0.33) HRH2HRH1HRH4HRH3OPRD1
Trifluoroacetic Acid SCHEMBL6999298 0.87 HRH2 (0.37) HRH2HRH1HRH4HRH3OPRD1
Trifluoroacetic Acid SCHEMBL5205822 0.87 F2 (0.34) HRH2HRH1HRH4HRH3OPRD1
Trifluoroacetic Acid SCHEMBL6994655 0.84 OPRD1 (0.34) OPRD1OPRM1OPRK1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL5207971 0.83 HRH2 (0.37) HRH2HRH1HRH4HRH3TPSAB1
SCHEMBL6991435 0.81 F2 (0.35) OPRD1OPRM1OPRK1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL5209729 0.80 F2 (0.34) OPRD1OPRM1OPRK1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL6995379 0.78 TP53 (0.39) MEN1KMT2AMAPTRAB9A
Trifluoroacetic Acid SCHEMBL7432339 0.77 LMNA (0.37) OPRD1OPRM1MEN1KMT2APKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1343561-A1 SERINE PROTEASE INHIBITORS Tularik Limited (GB) 2003-09-17 EP disclosed
WO-2002047762-A1 SERINE PROTEASE INHIBITORS TULARIK LIMITED (GB) 2002-06-20 WO disclosed