Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8314669

O=C(O)C(F)(F)F.O=C(O)COc1ccc(C(CNC(=O)c2cc3c(s2)CCNC3)Oc2cccnc2)cc1OCC(=O)O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 14/20 0.54
ITGA2B P08514 14/20 0.54
TPSAB1 Q15661 1/20 0.35
TPSD1 Q9BZJ3 1/20 0.35
TPSG1 Q9NRR2 1/20 0.35
PNMT P11086 2/20 0.32
POLB P06746 1/20 0.32
PPARD Q03181 1/20 0.31
ITGAV P06756 1/20 0.31

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 SCHEMBL8318651 0.92 ITGB3 (0.56) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8318464 0.88 ITGB3 (0.61) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8313229 0.87 ITGB3 (0.57) ITGB3ITGA2BTPSAB1TPSD1TPSG1
Trifluoroacetic Acid SCHEMBL8316509 0.87 ITGB3 (0.45) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8554231 0.85 ITGB3 (0.63) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8318658 0.84 ITGB3 (0.48) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL8315797 0.82 ITGB3 (0.48) ITGB3ITGA2BTPSAB1TPSD1TPSG1
Trifluoroacetic Acid SCHEMBL8555663 0.81 ITGB3 (0.47) ITGB3ITGA2BTPSAB1TPSD1TPSG1
Hydrochloric Acid SCHEMBL8319022 0.81 ITGB3 (0.44) ITGB3ITGA2BTPSAB1TPSD1TPSG1
Hydrochloric Acid SCHEMBL8319013 0.80 ITGB3 (0.46) ITGB3ITGA2BTPSAB1TPSD1TPSG1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0897920-A1 NOVEL HETEROCYCLIC COMPOUNDS HAVING PLATELET AGGREGATION INHIBITORY EFFECTS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1999-02-24 EP disclosed