Trifluoroacetic Acid

SCHEMBL3968945

N=C(N)c1ccc(CC(=O)C(=O)O)c(OC[C@@H](CC(=O)O)NC(=O)c2ccc(C(=O)O)cc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.63

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	F10	P00742	11/20	0.63

▸	F2	P00734	3/20	0.55

▸	ITGB3	P05106	5/20	0.37

▸	ITGA2B	P08514	5/20	0.37

▸	TMPRSS15	P98073	3/20	0.36

▸	PRSS1	P07477	1/20	0.36

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.

Compound	similarity	top predicted	shared targets
Trifluoroacetic Acid SCHEMBL3900443	0.96	F10 (0.65)	F10F2ITGB3ITGA2BTMPRSS15
SCHEMBL3897939	0.95	F10 (0.69)	F10F2ITGB3ITGA2BTMPRSS15
Trifluoroacetic Acid SCHEMBL3901682	0.91	F10 (0.61)	F10F2ITGB3ITGA2BTMPRSS15
SCHEMBL3894701	0.91	F10 (0.71)	F10F2ITGB3ITGA2BTMPRSS15
SCHEMBL3969718	0.89	F10 (0.57)	F10F2ITGB3ITGA2BTMPRSS15
Trifluoroacetic Acid SCHEMBL3912329	0.89	F10 (0.65)	F10F2ITGB3ITGA2BPRSS1
Trifluoroacetic Acid SCHEMBL3907403	0.87	F10 (0.61)	F10F2ITGB3ITGA2BPRSS1
SCHEMBL13901239	0.86	F10 (0.59)	F10F2ITGB3ITGA2BTMPRSS15
SCHEMBL3896589	0.85	F10 (0.66)	F10F2ITGB3ITGA2BTMPRSS15
Trifluoroacetic Acid SCHEMBL4680876	0.85	F10 (0.52)	F10F2TMPRSS15PRSS1

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
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