Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8553663

NC[C@H]1CC[C@H](C(=O)NCC(=O)c2ccc(OCC(=O)O)c(OCC(=O)O)c2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 9/20 0.88
ITGA2B P08514 9/20 0.88
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
F11 P03951 10/20 0.41
KLKB1 P03952 10/20 0.41
F10 P00742 1/20 0.37

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 SCHEMBL8553251 0.89 ITGB3 (0.69) ITGB3ITGA2BMEN1KMT2A
Trifluoroacetic Acid SCHEMBL8556981 0.83 ITGB3 (0.62) ITGB3ITGA2BMEN1KMT2AF11
SCHEMBL8557659 0.81 ITGB3 (0.76) ITGB3ITGA2BMEN1KMT2AF10
SCHEMBL8557508 0.81 ITGB3 (0.76) ITGB3ITGA2BMEN1KMT2A
SCHEMBL8559373 0.80 ITGB3 (0.74) ITGB3ITGA2BMEN1KMT2A
SCHEMBL8552738 0.79 ITGB3 (0.69) ITGB3ITGA2BMEN1KMT2A
SCHEMBL8554765 0.78 ITGB3 (0.71) ITGB3ITGA2BMEN1KMT2AF10
SCHEMBL8557506 0.77 ITGB3 (0.70) ITGB3ITGA2BMEN1KMT2A
Trifluoroacetic Acid SCHEMBL8556612 0.77 MEN1 (0.53) ITGB3ITGA2BMEN1KMT2A
SCHEMBL8556201 0.77 ITGB3 (0.66) ITGB3ITGA2BMEN1KMT2A

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-0641770-B1 NOVEL COMPOUND WITH PLATELET AGGREGATION INHIBITOR ACTIVITY MEIJI SEIKA CO (JP) 1998-05-13 EP disclosed
US-5594004-A CARDIOVASCULAR DISORDERS AND ANTICOAGULANTS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-01-14 US disclosed
EP-0641770-A1 NOVEL COMPOUND WITH PLATELET AGGREGATION INHIBITOR ACTIVITY MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-03-08 EP disclosed