Trimethylammonium

Trimethylammonium

SCHEMBL1302912

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

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.39
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
ZDHHC20 Q5W0Z9 1/20 0.30
ZDHHC2 Q9UIJ5 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
SCHEMBL6285624 0.94 TSHR (0.42) TSHRHPGDTHRBALDH1A1TP53
Trimethylammonium SCHEMBL1302569 0.85 TSHR (0.38) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL19514114 0.84 TSHR (0.51) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL7895166 0.82 TSHR (0.47) TSHRHPGDTHRBZDHHC20ZDHHC2
SCHEMBL6386865 0.81 TSHR (0.46) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL28447852 0.81 TSHR (0.46) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL29024986 0.81 TSHR (0.46) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL1653497 0.81 TSHR (0.46) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL10818152 0.81 TSHR (0.46) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL29074262 0.81 TSHR (0.46) TSHRHPGDTHRBALDH1A1CYP3A4

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