Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8644121

COCCC(=O)C(NC(=O)c1ccc(C(=N)N)cc1)(Oc1ccccc1)C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KLK1 P06870 2/20 0.41
KLK5 Q9Y337 2/20 0.41
F10 P00742 2/20 0.41
F2 P00734 8/20 0.38
TMPRSS6 Q8IU80 7/20 0.38
ITGB3 P05106 1/20 0.36
ITGA2B P08514 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.

Compoundsimilaritytop predictedshared targets
Trifluoroacetic Acid SCHEMBL8648364 0.91 KLK1 (0.39) KLK1KLK5F10F2TMPRSS6
Trifluoroacetic Acid SCHEMBL8643480 0.89 KLK1 (0.43) KLK1KLK5F10F2TMPRSS6
Trifluoroacetic Acid SCHEMBL8646468 0.89 KLK1 (0.43) KLK1KLK5F10F2TMPRSS6
Trifluoroacetic Acid SCHEMBL8642843 0.88 KLK1 (0.40) KLK1KLK5F10F2TMPRSS6
SCHEMBL8643874 0.88 F10 (0.39) KLK1KLK5F10F2ITGB3
Trifluoroacetic Acid SCHEMBL8644459 0.87 F10 (0.41) KLK1KLK5F10F2TMPRSS6
Hydrochloric Acid SCHEMBL8643111 0.87 F10 (0.38) KLK1KLK5F10F2TMPRSS6
SCHEMBL8644198 0.86 F10 (0.40) KLK1KLK5F10F2ITGB3
Trifluoroacetic Acid SCHEMBL8644842 0.86 KLK1 (0.40) KLK1KLK5F10F2TMPRSS6
SCHEMBL8645969 0.85 F10 (0.40) KLK1F10F2ITGB3ITGA2B

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
US-5726185-A BINDING OF ADHESIVE PROTEINS TO BLOOD PLATELET AGGREGATION AND CELL TO CELL ADHESION HOFFMANN-LA ROCHE INC. (US) 1998-03-10 US disclosed