Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7326131

N=C(N)NCCCCCc1ccc2c(c1)C(=O)N(CCC(=O)O)CC(=O)N2C(c1ccccc1)c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 4/20 0.38
ITGA2B P08514 4/20 0.38
ITGA2 P17301 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
F7 P08709 3/20 0.33
F3 P13726 3/20 0.33
NPY4R P50391 1/20 0.33
ASAH1 Q13510 1/20 0.33
LIPG Q9Y5X9 2/20 0.32
NPY1R P25929 3/20 0.32
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
CXCR3 P49682 3/20 0.31
NAMPT P43490 2/20 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 SCHEMBL7353937 1.00 ITGB3 (0.38) ITGB3ITGA2BITGA2KDM4EALOX15
Trifluoroacetic Acid SCHEMBL7335741 0.99 ITGB3 (0.39) ITGB3ITGA2BITGA2KDM4EALOX15
SCHEMBL7354810 0.95 ITGB3 (0.41) ITGB3ITGA2BKDM4EALOX15TSHR
SCHEMBL7353955 0.90 ITGB3 (0.32) ITGB3ITGA2BASAH1LIPG
SCHEMBL7326139 0.90 ITGB3 (0.32) ITGB3ITGA2BASAH1LIPG
SCHEMBL7335746 0.89 ITGB3 (0.33) ITGB3ITGA2BASAH1LIPG
Trifluoroacetic Acid SCHEMBL7323735 0.89 KDM4E (0.37) ITGB3ITGA2BITGA2KDM4EALOX15
Trifluoroacetic Acid SCHEMBL7327519 0.89 KDM4E (0.37) ITGB3ITGA2BITGA2KDM4EALOX15
Trifluoroacetic Acid SCHEMBL7330241 0.88 KDM4E (0.38) ITGB3ITGA2BITGA2KDM4EALOX15
Trifluoroacetic Acid SCHEMBL7326800 0.87 ITGB3 (0.40) ITGB3ITGA2BITGA2KDM4EALOX15

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 8 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
US-5403836-A Anticoagulants GENENTECH, INC. (US) 1995-04-04 US disclosed
US-5250679-A Nonpeptidyl platelet aggregation inhibitors having specificity for the GPIIb III.sub. receptor GENENTECH, INC. (US) 1993-10-05 US disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed