Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8206820

NCC(F)(F)F.O=C(O)C(F)(F)F.O=C(O)c1cc2c(F)cccc2[nH]1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALB P02768 10/20 0.47
IL2 P60568 10/20 0.47
FLT3 P36888 2/20 0.47
HRH4 Q9H3N8 2/20 0.46
SRD5A2 P31213 1/20 0.45
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 2/20 0.44
MEN1 O00255 1/20 0.44
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
CYP1A2 P05177 1/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C19 P33261 1/20 0.44
AHR P35869 1/20 0.44
CHRNA7 P36544 1/20 0.44
KMT2A Q03164 1/20 0.44

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
Trifluoroacetamide SCHEMBL8206818 0.89 FLT3 (0.49) ALBIL2FLT3HRH4SRD5A2
SCHEMBL30189206 0.84 FLT3 (0.60) ALBIL2FLT3HRH4SRD5A2
SCHEMBL3417091 0.84 FLT3 (0.60) ALBIL2FLT3HRH4SRD5A2
Trifluoroacetic Acid SCHEMBL30680982 0.81 HRH4 (0.50) FLT3HRH4SRD5A2KDM4EALDH1A1
SCHEMBL15511675 0.75 FLT3 (0.57) ALBIL2FLT3HRH4KDM4E
SCHEMBL14765166 0.75 KDM4E (0.58) ALBIL2FLT3HRH4KDM4E
SCHEMBL8249945 0.74 FLT3 (0.55) ALBIL2FLT3HRH4SRD5A2
SCHEMBL1144458 0.73 KDM4E (0.53) FLT3SRD5A2KDM4EALDH1A1HSD17B10
SCHEMBL30310417 0.73 KDM4E (0.53) FLT3SRD5A2KDM4EALDH1A1HSD17B10
SCHEMBL16234660 0.72 HRH4 (0.59) ALBIL2FLT3HRH4KDM4E

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-1042288-A1 TRIPEPTIDYL PEPTIDASE INHIBITORS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2000-10-11 EP disclosed
WO-1999033801-A1 TRIPEPTIDYL PEPTIDASE INHIBITORS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1999-07-08 WO disclosed