Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7327277

N=C(N)NCCCCCc1ccc2c(c1)C(=O)N(C(CC(=O)O)c1ccccc1)CC(=O)N2Cc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ITGB3 P05106 7/20 0.36
ITGA2B P08514 7/20 0.36
LIPG Q9Y5X9 1/20 0.32
F7 P08709 1/20 0.32
F3 P13726 1/20 0.32
NAMPT P43490 2/20 0.32
ALDH1A1 P00352 2/20 0.32
ALDH3A1 P30838 2/20 0.32
ASAH1 Q13510 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
Trifluoroacetic Acid SCHEMBL7330476 0.91 ITGB3 (0.42) KMT2AITGB3ITGA2BLIPGF7
SCHEMBL7327280 0.90 ITGB3 (0.32) MEN1KMT2AITGB3ITGA2BLIPG
Trifluoroacetic Acid SCHEMBL7334280 0.90 ITGB3 (0.42) MEN1KMT2AITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7324962 0.89 MEN1 (0.37) MEN1KMT2AITGB3ITGA2BNAMPT
Trifluoroacetic Acid SCHEMBL7332006 0.89 MEN1 (0.40) MEN1KMT2AITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7331607 0.89 MEN1 (0.38) MEN1KMT2AITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7329492 0.84 MDM2 (0.35) F7F3
SCHEMBL7330483 0.83 ITGB3 (0.36) KMT2AITGB3ITGA2BLIPGALDH1A1
SCHEMBL7329123 0.81 HDAC3 (0.36) MEN1KMT2AITGB3ITGA2BF7
Trifluoroacetic Acid SCHEMBL7331914 0.81 MEN1 (0.35) MEN1KMT2AITGB3ITGA2B

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