Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL31004018

NCCOCCOCCNC(=O)NCCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 7/20 0.55
▸ CA12 O43570 2/20 0.52
▸ CA1 P00915 2/20 0.52
▸ CA2 P00918 2/20 0.52
▸ CA9 Q16790 2/20 0.52
▸ F2 P00734 1/20 0.51
▸ PRSS1 P07477 1/20 0.51
▸ PRSS2 P07478 1/20 0.51
▸ PRSS3 P35030 1/20 0.51
▸ TPSAB1 Q15661 1/20 0.51
▸ TDP1 Q9NUW8 5/20 0.51
▸ PKM P14618 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ ABL1 P00519 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ IDE P14735 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ RIN1 Q13671 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48

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 SCHEMBL1163788 0.90 PRSS1 (0.63) FOLH1CA12CA1CA2CA9
Trifluoroacetic Acid SCHEMBL2520452 0.90 PRSS1 (0.63) FOLH1CA12CA1CA2CA9
SCHEMBL13497854 0.84 PRSS1 (0.67) FOLH1CA12CA1CA2CA9
SCHEMBL1697052 0.84 PRSS1 (0.67) FOLH1CA12CA1CA2CA9
SCHEMBL13497916 0.84 PRSS1 (0.67) FOLH1CA12CA1CA2CA9
SCHEMBL24670280 0.83 PRSS1 (0.68) FOLH1CA12CA1CA2CA9
SCHEMBL24163378 0.83 PRSS1 (0.68) FOLH1CA12CA1CA2CA9
SCHEMBL18117435 0.83 PRSS1 (0.68) FOLH1CA12CA1CA2CA9
SCHEMBL24974563 0.83 PRSS1 (0.68) FOLH1CA12CA1CA2CA9
SCHEMBL21531161 0.83 PRSS1 (0.68) FOLH1CA12CA1CA2CA9

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
WO-2024151843-A1 TARGETED UNIVERSAL DELIVERY SYSTEM OF DON AND OTHER DRUGS THE JOHNS HOPKINS UNIVERSITY (US) 2024-07-18 — — WO disclosed
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