Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL13822271

N#Cc1nccc2[nH]nnc12.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GPR6 P46095 3/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PLCG1 P19174 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
SCHEMBL2146747 0.85 KCNMA1 (0.30) —
Trifluoroacetic Acid SCHEMBL3639222 0.80 EGLN1 (0.45) GPR6L3MBTL1PLCG1
SCHEMBL31394511 0.71 KDM4E (0.41) L3MBTL1
Trifluoroacetic Acid SCHEMBL30870503 0.68 L3MBTL1 (0.31) L3MBTL1
SCHEMBL22445946 0.64 KCNMA1 (0.33) L3MBTL1
SCHEMBL31146095 0.63 PLCG1 (0.31) PLCG1
Trifluoroacetic Acid SCHEMBL5259972 0.62 L3MBTL1 (0.37) L3MBTL1PLCG1
Trifluoroacetic Acid SCHEMBL30271702 0.62 HAO1 (0.31) —
SCHEMBL29769325 0.62 MAPK1 (0.44) —
SCHEMBL4828596 0.62 MAPK1 (0.44) —

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
EP-2523954-A1 1H-[1,2,3]TRIAZOLO[4,5-c]PYRIDINE-4-CARBONITRILE DERIVATIVES MSD Oss B.V. (NL) 2012-11-21 — — EP disclosed
Send feedback