Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7322919

CC(CC(=O)O)N1C(=O)c2cc(CCCCCNC(=N)N)ccc2N(c2ccccc2)C(=O)C1c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 3/20 0.33
F7 P08709 1/20 0.31
F3 P13726 1/20 0.31
MDM2 Q00987 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
ITGB3 P05106 1/20 0.30
ITGA2B P08514 1/20 0.30

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 SCHEMBL7324130 0.91 ITGB3 (0.34) NPY4RF7F3MDM2ALDH1A1
Trifluoroacetic Acid SCHEMBL7327322 0.91 MDM2 (0.30) NPY4RF7F3MDM2ITGB3
Trifluoroacetic Acid SCHEMBL7331099 0.91 NPY4R (0.33) NPY4RF7F3MDM2ALDH1A1
SCHEMBL7322927 0.90 ALDH1A1 (0.30) ALDH1A1KMT2A
Trifluoroacetic Acid SCHEMBL7323985 0.90 MDM2 (0.35) NPY4RF7F3MDM2ALDH1A1
Trifluoroacetic Acid SCHEMBL7331510 0.89 MDM2 (0.33) MDM2
Trifluoroacetic Acid SCHEMBL7333906 0.83 ITGB3 (0.42) NPY4RALDH1A1HPGDKMT2AITGB3
Trifluoroacetic Acid SCHEMBL7331626 0.83 NPY4R (0.32) NPY4RF7F3MDM2ITGB3
Trifluoroacetic Acid SCHEMBL8836993 0.83 MDM2 (0.34) NPY4RF7F3MDM2ITGB3
SCHEMBL7327329 0.83

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 9 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
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP 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