Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL19953228

NCc1cc2cc(-c3cncc(O)c3)ccc2[nH]1.O=C(O)C(F)(F)F

nearest known ligand 0.82

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 9/20 0.82
HSD17B1 P14061 1/20 0.43
PRMT5 O14744 1/20 0.42
WDR77 Q9BQA1 1/20 0.42
CDK5 Q00535 2/20 0.40
CDK5R1 Q15078 2/20 0.40
CDK7 P50613 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
IDO1 P14902 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
FDPS P14324 1/20 0.38
TDO2 P48775 1/20 0.36
MMP2 P08253 1/20 0.36
MMP13 P45452 1/20 0.36
MMP14 P50281 1/20 0.36

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
SCHEMBL19964478 0.91 LOXL2 (1.00) LOXL2HSD17B1PRMT5WDR77CDK5
SCHEMBL19953229 0.81 LOXL2 (0.60) LOXL2PRMT5WDR77CDK5CDK5R1
Trifluoroacetic Acid SCHEMBL6066580 0.75 DAO (0.46) LOXL2
SCHEMBL19953230 0.75 LOXL2 (0.63) LOXL2CYP11B1CYP11B2MMP2MMP13
SCHEMBL19953274 0.71 LOXL2 (0.65) LOXL2CYP11B1CYP11B2IDO1MMP2
Trifluoroacetic Acid SCHEMBL30557266 0.70 FDPS (0.50) LOXL2HSD17B1CDK7CYP11B1CYP11B2
SCHEMBL19953414 0.69 LOXL2 (0.57) LOXL2IDO1
Trifluoroacetic Acid SCHEMBL23460742 0.67 LOXL2 (0.40) LOXL2CDK7
SCHEMBL19953219 0.67 LOXL2 (0.60) LOXL2PRMT5WDR77
SCHEMBL19211311 0.67 PRMT5 (0.56) LOXL2PRMT5WDR77CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018048930-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 WO disclosed