Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL28336572

CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1F.O=C(O)C(F)(F)F

nearest known ligand 0.82

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SCN5A Q14524 11/20 0.82
▸ SCN7A Q01118 10/20 0.82
▸ SCN9A Q15858 14/20 0.70
▸ SCN1A P35498 2/20 0.67
▸ SCN4A P35499 2/20 0.67
▸ SCN2A Q99250 2/20 0.67
▸ SCN8A Q9UQD0 2/20 0.67
▸ SCN2B O60939 1/20 0.67
▸ SCN1B Q07699 1/20 0.67
▸ SCN3A Q9NY46 1/20 0.60

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
SCHEMBL16770662 0.95 SCN5A (0.87) SCN5ASCN7ASCN9ASCN1ASCN4A
Trifluoroacetic Acid SCHEMBL28338580 0.94 SCN7A (0.80) SCN5ASCN7ASCN9ASCN1ASCN4A
Trifluoroacetic Acid SCHEMBL28338694 0.92 SCN9A (0.71) SCN5ASCN7ASCN9ASCN1ASCN4A
SCHEMBL15535957 0.90 SCN7A (1.00) SCN5ASCN7ASCN9ASCN1ASCN4A
Trifluoroacetic Acid SCHEMBL28336602 0.90 SCN9A (0.73) SCN5ASCN7ASCN9A
Trifluoroacetic Acid SCHEMBL16759019 0.90 SCN7A (0.83) SCN5ASCN7ASCN9ASCN1ASCN4A
Trifluoroacetic Acid SCHEMBL28336502 0.90 SCN7A (0.80) SCN5ASCN7ASCN9ASCN1ASCN4A
SCHEMBL16770617 0.89 SCN5A (0.84) SCN5ASCN7ASCN9ASCN1ASCN4A
Trifluoroacetic Acid SCHEMBL28336589 0.87 SCN7A (0.76) SCN5ASCN7ASCN9ASCN1ASCN4A
SCHEMBL16759414 0.86 SCN9A (0.93) SCN5ASCN7ASCN9ASCN1ASCN4A

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
CN-105793238-B Substituted benzamides and methods of use thereof 基因泰克公司 2019-12-24 — — CN disclosed
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