Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7330476

CC(CC(=O)O)N1CC(=O)N(Cc2ccccc2)c2ccc(CCCCCNC(=N)N)cc2C1=O.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 10/20 0.42
ITGA2B P08514 10/20 0.42
NPY4R P50391 1/20 0.34
PTGDR2 Q9Y5Y4 3/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
F7 P08709 1/20 0.32
F3 P13726 1/20 0.32

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
SCHEMBL7330483 0.91 ITGB3 (0.36) ITGB3ITGA2BPTGDR2POLBALDH1A1
Trifluoroacetic Acid SCHEMBL7327277 0.91 MEN1 (0.37) ITGB3ITGA2BALDH1A1KMT2ALIPG
Trifluoroacetic Acid SCHEMBL7333906 0.89 ITGB3 (0.42) ITGB3ITGA2BNPY4RALDH1A1HPGD
Trifluoroacetic Acid SCHEMBL7333452 0.89 ITGB3 (0.54) ITGB3ITGA2BNPY4RLIPG
Trifluoroacetic Acid SCHEMBL7331327 0.89 ITGB3 (0.41) ITGB3ITGA2BPTGDR2
Trifluoroacetic Acid SCHEMBL7323741 0.88 ITGB3 (0.44) ITGB3ITGA2BNPY4R
SCHEMBL7327280 0.84 ITGB3 (0.32) ITGB3ITGA2BPOLBKMT2ALIPG
Trifluoroacetic Acid SCHEMBL7323985 0.84 MDM2 (0.35) NPY4RALDH1A1HPGDKMT2AF7
Trifluoroacetic Acid SCHEMBL7331607 0.82 MEN1 (0.38) ITGB3ITGA2BNPY4RKMT2A
Trifluoroacetic Acid SCHEMBL7334280 0.82 ITGB3 (0.42) ITGB3ITGA2BNPY4RKMT2A

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