Dimethylamine

Dimethylamine

SCHEMBL1303183

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

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.42
HPGD P15428 1/20 0.39
THRB P10828 3/20 0.33
ZDHHC7 Q9NXF8 1/20 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
CTSK P43235 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
ZDHHC20 Q5W0Z9 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
SCHEMBL8970460 0.94 TSHR (0.46) TSHRHPGDTHRBZDHHC7ALDH1A1
Trimethylammonium SCHEMBL1301313 0.89 TSHR (0.42) TSHRHPGDTHRBALDH1A1TP53
Dimethylamine SCHEMBL1302467 0.85 TSHR (0.41) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL2396349 0.82 TSHR (0.50) TSHRHPGDTHRBZDHHC7ZDHHC20
SCHEMBL28430041 0.81 TSHR (0.49) TSHRHPGDTHRBZDHHC7ALDH1A1
SCHEMBL6896970 0.81 TSHR (0.49) TSHRHPGDTHRBZDHHC7ALDH1A1
Dimethylamine SCHEMBL1303093 0.80 TSHR (0.40) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL2441939 0.79
Dimethylamine SCHEMBL1302505 0.79 TSHR (0.39) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL5504190 0.78 TSHR (0.41) 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