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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3900097

CCS(=O)(=O)N[C@H](COc1cccc(C(=N)N)c1)Cc1ccc(OS(=O)(=O)CC)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 7/20 0.47
▸ F2 P00734 11/20 0.42
▸ TMPRSS6 Q8IU80 6/20 0.42
▸ F3 P13726 5/20 0.41
▸ F7 P08709 2/20 0.41

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
SCHEMBL5105570 0.94 F10 (0.48) F10F2
SCHEMBL5105574 0.94 F10 (0.48) F10F2
Trifluoroacetic Acid SCHEMBL3901640 0.90 ITGB3 (0.48) F10F2TMPRSS6F3F7
Trifluoroacetic Acid SCHEMBL3912132 0.84 F10 (0.43) F10F2TMPRSS6F3F7
Trifluoroacetic Acid SCHEMBL3895701 0.84 F10 (0.43) F10F2TMPRSS6F3F7
Trifluoroacetic Acid SCHEMBL3897893 0.83 ITGB3 (0.49) F10F2TMPRSS6F3F7
SCHEMBL14132287 0.83 ITGB3 (0.48) F10F2
Trifluoroacetic Acid SCHEMBL5105075 0.82 F10 (0.57) F10F2
SCHEMBL3897896 0.81 ITGB3 (0.47) F10F2TMPRSS6F3F7
SCHEMBL3897898 0.81 ITGB3 (0.47) F10F2TMPRSS6F3F7

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
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