N,N-Dimethylethanaminium

N,N-Dimethylethanaminium

SCHEMBL3206264

C=CC(=O)OCC(C)(C)C.CCN(C)C

nearest known ligand 0.48

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Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
TP53 P04637 3/20 0.48
HIF1A Q16665 3/20 0.48
CYP3A4 P08684 2/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
THRB P10828 3/20 0.45
TSHR P16473 8/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL285659 0.88 ALDH1A1 (0.59) ALDH1A1TP53HIF1ACYP3A4MAPK1
Ammonia Solution, Strong SCHEMBL11107036 0.86 ALDH1A1 (0.57) ALDH1A1TP53HIF1ACYP3A4MAPK1
Hydrochloric Acid SCHEMBL28271407 0.84 ALDH1A1 (0.55) ALDH1A1TP53HIF1ACYP3A4MAPK1
Dimethylamine SCHEMBL6114524 0.82 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
Ethylene Glycol SCHEMBL230725 0.82 ALDH1A1 (0.59) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL444412 0.80 TSHR (0.50) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL8027705 0.79 TSHR (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL4632473 0.79 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
Acrylic Acid Ethyl Ester SCHEMBL15387422 0.79 TSHR (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL15268464 0.78 ALDH1A1 (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11013583-B2 Three dimensional fabricating material systems and methods for producing layered dental products DENTSPLY SIRONA INC. (US) 2021-05-25 US disclosed
US-10639877-B2 Three-dimensional printing systems for rapidly producing objects DENTSPLY SIRONA INC. (US) 2020-05-05 US disclosed
US-20190152097-A1 THREE-DIMENSIONAL FABRICATING SYSTEMS FOR RAPIDLY PRODUCING OBJECTS DENTSPLY SIRONA INC. (US) 2019-05-23 US disclosed
US-20190053883-A1 THREE DIMENSIONAL FABRICATING MATERIAL SYSTEMS AND METHODS FOR PRODUCING LAYERED DENTAL PRODUCTS DENTSPLY SIRONA INC. (US) 2019-02-21 US disclosed
US-20160332367-A1 THREE-DIMENSIONAL PRINTING SYSTEMS FOR RAPIDLY PRODUCING OBJECTS DENTSPLY SIRONA INC. (US) 2016-11-17 US disclosed
US-20100044895-A1 Method of forming a dental product DENTSPLY INTERNATIONAL INC. 2010-02-25 US disclosed
US-20090148813-A1 Three-dimensional printing methods and materials for making dental products SUN BENJAMIN J 2009-06-11 US disclosed
US-20090130624-A1 Methods and kits for making flexible dental guards SUN BENJAMIN JIEMIN 2009-05-21 US disclosed
US-4892478-A Method of preparing dental appliances DENTSPLY RESEARCH & DEVELOPMENT CORP. (US) 1990-01-09 US disclosed
EP-0334256-A2 Dental appliance preparation and material therefor DENTSPLY INTERNATIONAL, INC. (US) 1989-09-27 EP disclosed