Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9618064

C#CCOC(=O)CN.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.35
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ACHE P22303 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL44355 0.86
Glycine SCHEMBL9114763 0.84 GLRA1 (0.43) GSTP1NPC1ALDH1A1TAAR1SLC1A3
Trifluoroacetic Acid SCHEMBL9479993 0.79
Trifluoroacetic Acid SCHEMBL27947517 0.75 HRH4 (0.33) CA12CA1CA2CA9
Trifluoroacetic Acid SCHEMBL27519761 0.75 CYP1A2 (0.45) ALDH1A1POLB
Trifluoroacetic Acid SCHEMBL10952565 0.75 HTT (0.43) ALDH1A1CA1CA2CA9
Trifluoroacetic Acid SCHEMBL30293182 0.72 CA12 (0.34) CA12CA1CA2CA9
Trifluoroacetic Acid SCHEMBL4666819 0.71 NOS1 (0.35) NPC1ACHE
SCHEMBL21228301 0.71 NPC1 (0.41) GSTP1NPC1SLC1A3SLC1A2SLC1A1
SCHEMBL16685813 0.70 ALDH1A1 (0.41) GSTP1NPC1ALDH1A1TAAR1L3MBTL1

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
JP-4082893-A None JP disclosed
JP-H0482893-A PEPTIDE-DERIVED PHOSPHOLIPID COMPOUND AND PRODUCTION OF POLYPEPTIDE LIPOSOME USING THE SAME FUJI PHOTO FILM CO LTD 1992-03-16 JP disclosed
JP-H00482893-A 0001-01-01 JP disclosed