Tetrylammonium

Tetrylammonium

SCHEMBL5022979

CC[N+](CC)(CC)CC.CC[N+](CC)(CC)CC.CC[N+](CC)(CC)CC.O=C(O)C(=O)O.O=C(O)C(=O)O.O=C(O)C(=O)O.O=C(O)CCC(F)(F)F.O=C(O)CCC(F)(F)F.O=C(O)CCC(F)(F)F.[O-]B([O-])[O-]

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1SLC6A4

The experimentally established mechanism targets of Tetrylammonium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
THRB P10828 1/20 0.34
KMT2A Q03164 1/20 0.34
NAALAD2 Q9Y3Q0 1/20 0.33
FFAR3 O14843 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
MAPK1 P28482 1/20 0.30
SLC13A3 Q8WWT9 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
OR51E2 Q9H255 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
Oxalic Acid SCHEMBL5013723 0.88 BBOX1 (0.33) MEN1ALDH1A1CYP1A2THRBKMT2A
Oxalic Acid SCHEMBL2420699 0.85 EGLN1 (0.37) MEN1ALDH1A1CYP1A2THRBKMT2A
Oxalic Acid SCHEMBL28801176 0.79 LMNA (0.42) MEN1ALDH1A1CYP1A2THRBKMT2A
Tetrylammonium SCHEMBL5015082 0.78 TSHR (0.32)
Tetrylammonium SCHEMBL5013736 0.75
Tetrylammonium SCHEMBL5015124 0.75
SCHEMBL27890788 0.74 LMNA (0.47) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL38157 0.74
Tetrylammonium SCHEMBL5015099 0.74 ALDH1A1 (0.33) ALDH1A1
Tetrylammonium SCHEMBL5014690 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8652682-B2 Ionic compound, electrolytic solution, electrochemical device, and battery SONY CORPORATION (JP) 2014-02-18 US disclosed
US-20080118845-A1 IONIC COMPOUND, ELECTROLYTIC SOLUTION, ELECTROCHEMICAL DEVICE, AND BATTERY SONY CORPORATION (JP) 2008-05-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080118845-A1 IONIC COMPOUND, ELECTROLYTIC SOLUTION, ELECTROCHEMICAL DEVICE, AND BATTERY CA2, DUOX2, OTC MEN1 3401/4885ALDH1A1 2771/4885CYP1A2 3687/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.