Trimethylammonium

Trimethylammonium

SCHEMBL1301313

C=CC(=O)OC(Br)CCC.CN(C)C

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.42
HPGD P15428 1/20 0.39
THRB P10828 3/20 0.33
ALDH1A1 P00352 5/20 0.32
TP53 P04637 3/20 0.32
HIF1A Q16665 3/20 0.32
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL8970460 0.94 TSHR (0.46) TSHRHPGDTHRBALDH1A1TP53
Dimethylamine SCHEMBL1303183 0.89 TSHR (0.42) TSHRHPGDTHRBALDH1A1TP53
Trimethylammonium SCHEMBL1301957 0.85 TSHR (0.41) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL2396349 0.82 TSHR (0.50) TSHRHPGDTHRB
SCHEMBL28430041 0.81 TSHR (0.49) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL6896970 0.81 TSHR (0.49) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL2441939 0.79
Trimethylammonium SCHEMBL1302466 0.79 TSHR (0.39) TSHRHPGDTHRBALDH1A1TP53
Trimethylammonium SCHEMBL1302757 0.79 TSHR (0.39) TSHRHPGDTHRBALDH1A1TP53
Trimethylammonium SCHEMBL1302912 0.79 TSHR (0.39) TSHRHPGDTHRBALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2387866-A1 ELECTROMAGNETIC WAVE SHIELDING GEL-LIKE COMPOSITION 3M Innovative Properties Company (US) 2011-11-23 EP disclosed
US-20110268950-A1 Electromagnetic Wave Shielding Gel-Like Composition 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-11-03 US disclosed
US-8038066-B2 Laser scanner with deformable lens HAND HELD PRODUCTS, INC. (US) 2011-10-18 US disclosed
WO-2010083075-A1 ELECTROMAGNETIC WAVE SHIELDING GEL-LIKE COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-07-22 WO disclosed