Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3900237

CN(C)C(=N)c1ccc(C(=O)N[C@@H](COc2cccc(C#N)c2)CC(=O)O)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.56
PIN1 Q13526 2/20 0.45
TMPRSS15 P98073 1/20 0.37
GPR34 Q9UPC5 1/20 0.37
MME P08473 1/20 0.36
EGLN2 Q96KS0 3/20 0.36
EGLN1 Q9GZT9 3/20 0.36
PPARG P37231 1/20 0.36
HTRA1 Q92743 1/20 0.36
MAOB P27338 1/20 0.36
ITGB3 P05106 2/20 0.36
ITGAV P06756 2/20 0.36
ITGB1 P05556 1/20 0.36
ITGA5 P08648 1/20 0.36
GAA P10253 1/20 0.35

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 SCHEMBL3900234 1.00 F10 (0.56) F10PIN1TMPRSS15GPR34MME
Trifluoroacetic Acid SCHEMBL3898447 0.88 F10 (0.74) F10TMPRSS15
Trifluoroacetic Acid SCHEMBL3899320 0.86 F10 (0.60) F10PIN1TMPRSS15GPR34MME
SCHEMBL3907511 0.86 F10 (0.58) F10PIN1GPR34MMEEGLN2
SCHEMBL3901279 0.83 F10 (0.65) F10PIN1GPR34MMEEGLN2
SCHEMBL3895734 0.83 F10 (0.65) F10PIN1GPR34MMEEGLN2
Trifluoroacetic Acid SCHEMBL3912178 0.82 F10 (0.51) F10PIN1
Trifluoroacetic Acid SCHEMBL3912179 0.82 F10 (0.51) F10PIN1
Trifluoroacetic Acid SCHEMBL3907846 0.82 F10 (0.52) F10GAA
SCHEMBL13901150 0.82 F10 (0.83) F10TMPRSS15

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.

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