Sugi Predict

Sugi Predict / Compounds / Trimethylammonium

Trimethylammonium

Trimethylammonium

SCHEMBL9560355

C=C(CCC)C(=O)O.CCOS(=O)(=O)O.CN(C)C.CN(C)C

nearest known ligand 0.30

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 1/20 0.30
▸ FNTB P49356 1/20 0.30
▸ FFAR3 O14843 1/20 0.30
▸ HDAC3 O15379 1/20 0.30
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC2 Q92769 1/20 0.30
▸ HDAC8 Q9BY41 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
SCHEMBL9101444 0.95 FFAR3 (0.33) FNTAFNTBFFAR3HDAC3HDAC1
N,N-Dimethylethanaminium SCHEMBL4258892 0.94 — —
N,N-Dimethylethanaminium SCHEMBL964537 0.94 — —
Dimethylamine SCHEMBL6548110 0.90 FNTA (0.33) FNTAFNTBFFAR3HDAC3HDAC1
Ethylamine SCHEMBL8944850 0.90 CA1 (0.32) FNTAFNTBFFAR3HDAC3HDAC1
Methylethylamine SCHEMBL5685009 0.87 FNTA (0.32) FNTAFNTB
Trimethylammonium SCHEMBL1345929 0.86 FFAR3 (0.32) FFAR3HDAC3HDAC1HDAC2HDAC8
Trimethylammonium SCHEMBL69320 0.86 FFAR3 (0.32) FFAR3HDAC3HDAC1HDAC2HDAC8
Sulfuric Acid SCHEMBL8399982 0.86 FFAR3 (0.37) FNTAFNTBFFAR3HDAC3HDAC1
Sulfuric Acid SCHEMBL16195481 0.86 FFAR3 (0.37) FNTAFNTBFFAR3HDAC3HDAC1

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
US-5180646-A Vinylpyrrolidone copolymer as expander DEUTSCHE AUTOMOBILGESELLSCHAFT MBH (DE) 1993-01-19 — — US disclosed