Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8563401

CC(C)CC(N)CN1CCOCC1.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
ANPEP P15144 1/20 0.42
LMNA P02545 2/20 0.41
KCNJ1 P48048 1/20 0.39
USP2 O75604 1/20 0.39
NPC1 O15118 1/20 0.39
DPP4 P27487 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MMP1 P03956 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
MMP14 P50281 1/20 0.36
SLC7A5 Q01650 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35

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 SCHEMBL8563404 1.00 ALDH1A1 (0.49) ALDH1A1ANPEPLMNAKCNJ1USP2
SCHEMBL8558131 0.84 USP2 (0.47) ALDH1A1ANPEPLMNAUSP2NPC1
SCHEMBL8558133 0.84 USP2 (0.47) ALDH1A1ANPEPLMNAUSP2NPC1
Trifluoroacetic Acid SCHEMBL27638155 0.80 ALDH1A1 (0.56) ALDH1A1ANPEPLMNAKCNJ1USP2
SCHEMBL9546912 0.72 ALDH1A1 (0.40) ALDH1A1ANPEPLMNAUSP2NPC1
Trifluoroacetic Acid SCHEMBL6229501 0.71 SLC7A5 (0.43) ANPEPLMNADPP4DPP8SLC7A5
Trifluoroacetic Acid SCHEMBL27041458 0.71 GAA (0.47) ALDH1A1LMNAKCNJ1DPP4DPP8
Trifluoroacetic Acid SCHEMBL3750649 0.70 KDM4E (0.75) ALDH1A1LMNAKCNJ1USP2KDM4E
Trifluoroacetic Acid SCHEMBL3750654 0.70 SMN1; SMN2 (0.50) ALDH1A1LMNAKCNJ1KDM4EHSD17B10
SCHEMBL372508 0.70 USP2 (0.58) ALDH1A1ANPEPLMNAUSP2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543861-B1 IMIDAZOPYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIOTECH PHARM (GB) 1998-10-14 EP disclosed
US-5276153-A Antagonist of platelet activating factor for bronchodilation BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-01-04 US disclosed
US-5180723-A Hypertensives, bronchodilators, antiedemic agents BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-01-19 US disclosed
WO-1992003422-A1 BENZIMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-03-05 WO disclosed