Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7860784

NCCC[C@@H](N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)NCc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FCER2 P06734 3/20 0.57
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51
MMP8 P22894 1/20 0.51
CTSB P07858 2/20 0.46
CTSS P25774 2/20 0.46
CTSL P07711 1/20 0.46
CTSK P43235 1/20 0.46
CHRNA1 P02708 1/20 0.46
CHRNG P07510 1/20 0.46
CHRNB1 P11230 1/20 0.46
CHRND Q07001 1/20 0.46
NPY1R P25929 1/20 0.46
TACR1 P25103 1/20 0.46
OPRD1 P41143 1/20 0.45
KLKB1 P03952 3/20 0.45
CTNNB1 P35222 1/20 0.45
LCK P06239 1/20 0.44
F2 P00734 1/20 0.44
TMPRSS6 Q8IU80 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
SCHEMBL7857865 0.94 FCER2 (0.60) FCER2MMP2MMP9MMP8CTSB
Trifluoroacetic Acid SCHEMBL7857126 0.88 OPRD1 (0.47) FCER2MMP2MMP9MMP8CTSB
Trifluoroacetic Acid SCHEMBL7857069 0.85 HRH4 (0.48) FCER2MMP2CTSSCTSKNPY1R
SCHEMBL7859128 0.85 CALCRL (0.51) FCER2MMP2MMP9MMP8CTSB
SCHEMBL7855910 0.83 FCER2 (0.47) FCER2MMP2MMP9MMP8CTSB
Trifluoroacetic Acid SCHEMBL7850362 0.83 MMP2 (0.43) FCER2MMP2MMP9CHRNA1CHRNG
Trifluoroacetic Acid SCHEMBL7860786 0.82 KDM4E (0.43) FCER2MMP2CTSL
SCHEMBL7850349 0.81 OPRD1 (0.50) FCER2MMP2MMP9MMP8CTSB
SCHEMBL8163585 0.81 MMP2 (0.49) MMP2MMP9MMP8CTSBCTSS
SCHEMBL29616642 0.80 MME (0.57) FCER2MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6245746-B1 ADMINISTERING AMIDE MICROBIOCIDE ANTIBIOTIC MICROCIDE PHARMACEUTICALS, INC. 2001-06-12 US disclosed
US-6114310-A THERAPY FOR MICROBIAL INFECTIONS MICROCIDE PHARMACEUTICALS, INC. (US) 2000-09-05 US disclosed
WO-1999037667-A1 EFFLUX PUMP INHIBITORS MICROCIDE PHARMACEUTICALS, INC. (US) 1999-07-29 WO disclosed