Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3897204

N=C(N)c1ccc(C(=O)N[C@H](COc2cccc(C(=N)N)c2)CC(=O)O)cc1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.88
TMPRSS15 P98073 2/20 0.48
F3 P13726 3/20 0.44
F7 P08709 2/20 0.44
PRSS1 P07477 4/20 0.44
F2 P00734 2/20 0.43
PLG P00747 1/20 0.43
PRSS2 P07478 1/20 0.43
C1S P09871 1/20 0.43
PRSS3 P35030 1/20 0.43
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43

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 SCHEMBL3902118 1.00 F10 (0.88) F10TMPRSS15F3F7PRSS1
Trifluoroacetic Acid SCHEMBL3900545 0.96 F10 (0.81) F10TMPRSS15F3F7PRSS1
Trifluoroacetic Acid SCHEMBL3901863 0.94 F10 (0.78) F10TMPRSS15F3F7PRSS1
SCHEMBL3898935 0.94 F10 (1.00) F10PRSS1F2PLGPRSS2
SCHEMBL3899344 0.94 F10 (1.00) F10PRSS1F2PLGPRSS2
Trifluoroacetic Acid SCHEMBL3906197 0.93 F10 (0.75) F10TMPRSS15PRSS1ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL3902772 0.92 F10 (0.74) F10TMPRSS15F3F7F2
Trifluoroacetic Acid SCHEMBL3898447 0.92 F10 (0.74) F10TMPRSS15F3F7PRSS1
Trifluoroacetic Acid SCHEMBL5105555 0.92 F10 (0.74) F10TMPRSS15F3F7F2
Trifluoroacetic Acid SCHEMBL3903088 0.90 F10 (0.71) F10TMPRSS15F3F7PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976722-B1 BENZAMIDINE DERIVATIVES AJINOMOTO KK (JP) 2009-03-11 EP disclosed
US-7396844-B1 Benzamidine derivatives AJINOMOTO CO., INC. (JP) 2008-07-08 US disclosed
EP-0976722-A1 BENZAMIDINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2000-02-02 EP disclosed