Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3899261

N=C(N)c1cccc(OC[C@@H](CC(=O)O)NC(=O)c2ccc(CC3CCNCC3)cc2)c1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.65
PRSS1 P07477 3/20 0.43
F2 P00734 1/20 0.43
ITGB3 P05106 2/20 0.40
ITGA2B P08514 2/20 0.40
TMPRSS15 P98073 1/20 0.40
F3 P13726 3/20 0.39
F7 P08709 2/20 0.39

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
SCHEMBL14132179 0.95 F10 (0.72) F10PRSS1F2ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL5105074 0.89 F10 (0.62) F10PRSS1F2ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL3902118 0.86 F10 (0.88) F10PRSS1F2ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL3897204 0.86 F10 (0.88) F10PRSS1F2ITGB3ITGA2B
SCHEMBL14132294 0.85 F10 (0.56) F10PRSS1F2ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL3900545 0.84 F10 (0.81) F10PRSS1F2TMPRSS15F3
Trifluoroacetic Acid SCHEMBL3900529 0.84 F10 (0.62) F10PRSS1F2ITGB3ITGA2B
SCHEMBL14131902 0.83 F10 (0.68) F10PRSS1F2ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL3901863 0.83 F10 (0.78) F10PRSS1F2TMPRSS15F3
Trifluoroacetic Acid SCHEMBL3901253 0.82 F2 (0.49) F10F2ITGB3ITGA2B

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