Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3865155

CN1CCC[C@H](N(Cc2cc(-c3ccc4[nH]ccc4c3)ccc2F)C(=O)c2ccc(F)cc2)C1.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FASN P49327 2/20 0.42
▸ AGER Q15109 2/20 0.37
▸ MTNR1A P48039 1/20 0.37
▸ ACHE P22303 4/20 0.36
▸ HTR4 Q13639 4/20 0.36
▸ CCR3 P51677 2/20 0.35
▸ GHSR Q92847 1/20 0.35
▸ ACACB O00763 1/20 0.35
▸ ACACA Q13085 1/20 0.35
▸ NAMPT P43490 1/20 0.35
▸ BRAF P15056 1/20 0.34
▸ ABL1 P00519 1/20 0.34
▸ BCR P11274 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34
▸ WDR5 P61964 1/20 0.34

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 SCHEMBL3693841 0.88 GRIN2B (0.41) FASNAGERMTNR1ACCR3NAMPT
SCHEMBL3701259 0.85 FASN (0.42) FASN
Trifluoroacetic Acid SCHEMBL3700536 0.83 GRIN2B (0.42) FASNABL1BCR
Trifluoroacetic Acid SCHEMBL3697501 0.83 GRIN2B (0.42) FASNABL1BCR
Trifluoroacetic Acid SCHEMBL3700540 0.83 GRIN2B (0.42) FASNABL1BCR
SCHEMBL3701385 0.83 GRIN2B (0.44) CCR3NAMPT
SCHEMBL3698083 0.82 HTR2A (0.42) FASNACHEHTR4ACACBACACA
SCHEMBL3696842 0.81 BRAF (0.41) FASNACHEHTR4BRAFABL1
SCHEMBL3700861 0.80 FASN (0.42) FASNAGER
SCHEMBL3697727 0.79 HTR2A (0.43) FASNGHSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928442-B1 COMBINATION OF A HYPNOTIC AGENT AND SUBSTITUTED BIS ARYL AND HETEROARYL COMPOUND AND THERAPEUTIC APPLICATION THEREOF AVENTIS PHARMA INC (US) 2009-11-04 — — EP disclosed
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