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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL27848409

CC(CC=N)NC(=O)OC(C)(C)C.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CTSK P43235 15/20 0.41
▸ CTSS P25774 7/20 0.41
▸ CTSL P07711 1/20 0.41
▸ CTSB P07858 1/20 0.41
▸ CYP2D6 P10635 1/20 0.38
▸ PPARG P37231 1/20 0.37
▸ PPARA Q07869 1/20 0.37

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
SCHEMBL27646608 0.91 CA1 (0.49) CA1CA2CA7CTSKCTSS
SCHEMBL27646611 0.91 CA1 (0.49) CA1CA2CA7CTSKCTSS
SCHEMBL27479498 0.91 CA1 (0.49) CA1CA2CA7CTSKCTSS
SCHEMBL12493046 0.77 CTSK (0.48) CA1CA2CA7CTSKCTSS
SCHEMBL12493044 0.77 CTSK (0.48) CA1CA2CA7CTSKCTSS
SCHEMBL5196577 0.76 CTSK (0.67) CA1CA2CA7CTSKCTSS
SCHEMBL2837458 0.76 CTSK (0.50) CA1CA2CA7CTSKCTSS
SCHEMBL2837459 0.76 CTSK (0.50) CA1CA2CA7CTSKCTSS
SCHEMBL75827 0.76 CTSK (0.53) CA1CA2CA7CTSKCTSS
SCHEMBL73696 0.76 CTSK (0.53) CA1CA2CA7CTSKCTSS

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
CN-101910158-A Pyridine and pyrazine derivatives useful in the treatment of cell proliferative disorders ASTRAZENECA AB 2010-12-08 — — CN disclosed
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