Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3898369

CCCCS(=O)(=O)N[C@H](COc1cccc(C(=N)N)c1)Cc1ccc(OC2CCN(C(=O)OCc3ccccc3)CC2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 10/20 0.44
▸ ITGB3 P05106 3/20 0.44
▸ ITGA2B P08514 3/20 0.44
▸ ST14 Q9Y5Y6 4/20 0.43
▸ HPN P05981 1/20 0.43
▸ LNPEP Q9UIQ6 1/20 0.40
▸ PLG P00747 4/20 0.39
▸ F2 P00734 4/20 0.39
▸ PLAU P00749 2/20 0.39
▸ TMPRSS6 Q8IU80 2/20 0.38

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
SCHEMBL14132066 0.97 ITGB3 (0.46) F10ITGB3ITGA2BST14HPN
Trifluoroacetic Acid SCHEMBL3900465 0.94 F10 (0.47) F10ST14HPNLNPEPPLG
Trifluoroacetic Acid SCHEMBL5105528 0.91 F10 (0.54) F10ITGB3ITGA2BPLGF2
SCHEMBL14132085 0.91 ST14 (0.48) F10ST14HPNLNPEPPLG
Trifluoroacetic Acid SCHEMBL3905613 0.89 ST14 (0.50) F10ITGB3ITGA2BST14HPN
Trifluoroacetic Acid SCHEMBL3900803 0.86 ITGB3 (0.51) F10ITGB3ITGA2BF2
Trifluoroacetic Acid SCHEMBL3901214 0.86 F10 (0.54) F10ST14HPNPLGF2
SCHEMBL14132067 0.86 F10 (0.55) F10ITGB3ITGA2BF2
SCHEMBL14132231 0.86 ST14 (0.53) F10ITGB3ITGA2BST14HPN
Trifluoroacetic Acid SCHEMBL5105075 0.85 F10 (0.57) F10PLGF2

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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