Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9463168

NC1COC1=O.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OAT P04181 1/20 0.37
F2 P00734 4/20 0.31
BLM P54132 2/20 0.30
MEN1 O00255 1/20 0.30
GRIN2D O15399 1/20 0.30
LMNA P02545 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 1/20 0.30
PTGS1 P23219 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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 SCHEMBL9462633 1.00 OAT (0.37) OATF2BLMMEN1GRIN2D
Trifluoroacetic Acid SCHEMBL9462962 1.00 OAT (0.37) OATF2BLMMEN1GRIN2D
SCHEMBL9462518 0.79
SCHEMBL486362 0.79
SCHEMBL3960005 0.79
Homoserine Lactone SCHEMBL27032863 0.79 OAT (0.34) OAT
Homoserine Lactone SCHEMBL11193272 0.79 OAT (0.34) OAT
Bromide SCHEMBL932220 0.77
SCHEMBL16641900 0.77 BLM (0.40) BLMMEN1GRIN2DLMNACYP3A4
Trifluoroacetic Acid SCHEMBL11197167 0.75 OAT (0.34) OAT

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
US-5200526-A Syntheses of optically pure α-amino acids from 3-amino-2-oxetanone salts THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 1993-04-06 US claimed
US-5200526-A Syntheses of optically pure α-amino acids from 3-amino-2-oxetanone salts THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 1993-04-06 US disclosed