Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3901214

N=C(N)c1cccc(OC[C@H](Cc2ccc(OC3CCN(C(=O)OCc4ccccc4)CC3)cc2)NS(=O)(=O)c2ccc3ccccc3c2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.54
PLG P00747 7/20 0.51
ST14 Q9Y5Y6 7/20 0.49
PLAU P00749 6/20 0.49
HPN P05981 4/20 0.49
F2 P00734 4/20 0.49
HGFAC Q04756 1/20 0.49
PLAT P00750 1/20 0.48

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
SCHEMBL14132293 0.97 F10 (0.57) F10PLGST14PLAUHPN
Trifluoroacetic Acid SCHEMBL3905613 0.94 ST14 (0.50) F10PLGST14PLAUHPN
Trifluoroacetic Acid SCHEMBL3896414 0.91 F10 (0.53) F10PLGST14PLAUHPN
SCHEMBL14132231 0.91 ST14 (0.53) F10PLGST14PLAUHPN
Trifluoroacetic Acid SCHEMBL3900465 0.89 F10 (0.47) F10PLGST14PLAUHPN
Trifluoroacetic Acid SCHEMBL3909125 0.88 F10 (0.48) F10PLGST14PLAUHPN
Trifluoroacetic Acid SCHEMBL3897239 0.87 F10 (0.51) F10PLGST14PLAUHPN
Trifluoroacetic Acid SCHEMBL3898369 0.86 F10 (0.44) F10PLGST14PLAUHPN
SCHEMBL14132091 0.86 F10 (0.54) F10PLGST14PLAUHPN
SCHEMBL14132085 0.86 ST14 (0.48) F10PLGST14PLAUHPN

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