Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5592808

CCCN1CCN(Cc2cccc(C(=O)NN(CC(C)C)c3nc(C#N)ncc3Cl)c2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.56
CTSS P25774 2/20 0.56
CTSK P43235 2/20 0.56
CTSB P07858 1/20 0.56
SLC2A1 P11166 5/20 0.39
GPR6 P46095 5/20 0.37
ACKR3 P25106 3/20 0.36
CDK14 O94921 1/20 0.36
CCNY Q8ND76 1/20 0.36
DRD4 P21917 1/20 0.36
WNT1 P04628 1/20 0.35
GSK3B P49841 1/20 0.35
DYRK1A Q13627 1/20 0.35
AGTR2 P50052 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
SCHEMBL5592907 0.95 CTSL (0.61) CTSLCTSSCTSKCTSBACKR3
Trifluoroacetic Acid SCHEMBL5593218 0.94 CTSL (0.56) CTSLCTSSCTSKCTSBSLC2A1
Trifluoroacetic Acid SCHEMBL5592876 0.93 CTSL (0.55) CTSLCTSSCTSKCTSBSLC2A1
Trifluoroacetic Acid SCHEMBL5592935 0.93 CTSL (0.55) CTSLCTSSCTSKCTSBSLC2A1
Trifluoroacetic Acid SCHEMBL5593235 0.92 CTSL (0.55) CTSLCTSSCTSKCTSBSLC2A1
Trifluoroacetic Acid SCHEMBL5592904 0.92 CTSL (0.66) CTSLCTSSCTSKCTSBSLC2A1
Trifluoroacetic Acid SCHEMBL5592810 0.91 CTSL (0.53) CTSLCTSSCTSKCTSBSLC2A1
Trifluoroacetic Acid SCHEMBL5592668 0.90 CTSL (0.58) CTSLCTSSCTSKCTSBSLC2A1
Trifluoroacetic Acid SCHEMBL5592941 0.89 CTSL (0.51) CTSLCTSSCTSKCTSBSLC2A1
SCHEMBL5592666 0.89 CTSL (0.61) CTSLCTSSCTSKCTSBACKR3

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-2007025775-A2 CYSTEINE PROTEASE INHIBITORS GLAXO GROUP LIMITED (GB) 2007-03-08 WO claimed