Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7352986

CC(C)CN1C(=O)CN(CCC(=O)O)C(=O)c2cc(OCCCCC(=N)N)ccc21.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 15/20 0.44
ITGA2B P08514 15/20 0.44
ITGA2 P17301 2/20 0.34
CASP3 P42574 1/20 0.34
CASP7 P55210 1/20 0.34
TRPA1 O75762 1/20 0.33
MDM2 Q00987 1/20 0.33
CHRM5 P08912 1/20 0.33
PDK2 Q15119 1/20 0.33

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 SCHEMBL7323573 0.91 ITGB3 (0.46) ITGB3ITGA2BITGA2CHRM5PDK2
SCHEMBL7352995 0.89 ITGB3 (0.36) ITGB3ITGA2BTRPA1CHRM5PDK2
Trifluoroacetic Acid SCHEMBL7319135 0.89 ITGB3 (0.45) ITGB3ITGA2BITGA2PDK2
SCHEMBL7425545 0.86 BRD4 (0.40) ITGB3ITGA2BPDK2
Trifluoroacetic Acid SCHEMBL7355147 0.85 ITGB3 (0.55) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7330412 0.84 ITGB3 (0.41) ITGB3ITGA2BITGA2PDK2
Trifluoroacetic Acid SCHEMBL7363449 0.84 ITGB3 (0.45) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7332946 0.80 ITGB3 (0.70) ITGB3ITGA2BITGA2TRPA1MDM2
SCHEMBL7323584 0.80 ITGB3 (0.37) ITGB3ITGA2BCHRM5PDK2
SCHEMBL7362438 0.80 ITGB3 (0.59) ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5674863-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
US-5674865-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
US-5663166-A ANTICOAGULANTS OF 1,4-BENZODIAZEPINE-2,5-DIONE AND 2-BENZOAZEPINE-1,4-DIONE DERIVATIVES; PREVENTS FIBRINOGEN BINDING NECESSARY FOR PLATELET AGGREGATION; SIDE EFFECT REDUCTION, E.G. EXCESSIVE BLEEDING GENENTECH, INC. (US) 1997-09-02 US disclosed
US-5565449-A PLATELET AGGREGATION INHIBITORS GENENTECH, INC. (US) 1996-10-15 US disclosed
EP-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed