Trimethylammonium

Trimethylammonium

SCHEMBL9619224

C=CC(=O)n1c2ccc1cc2.CN(C)C

nearest known ligand 0.36

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 8/20 0.36
AKT1 P31749 1/20 0.35
ALDH5A1 P51649 1/20 0.34
ABAT P80404 1/20 0.34
GSK3B P49841 1/20 0.33
PAX8 Q06710 2/20 0.33
THRB P10828 3/20 0.32
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
THRA P10827 2/20 0.32
TET3 O43151 1/20 0.31
KMT2A Q03164 1/20 0.31
FBXL19 Q6PCT2 1/20 0.31
CXXC5 Q7LFL8 1/20 0.31
TET1 Q8NFU7 1/20 0.31
KDM2B Q8NHM5 1/20 0.31
CXXC4 Q9H2H0 1/20 0.31
KDM2A Q9Y2K7 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TGM2 P21980 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
Trimethylammonium SCHEMBL9619079 0.70 MAPT (0.31)
SCHEMBL7154082 0.66 LMNA (0.35) ACHEGSK3BPAX8CYP2D6TSHR
SCHEMBL32689427 0.64 POLB (0.55) KMT2AALDH1A1
SCHEMBL811819 0.64 POLB (0.55) KMT2AALDH1A1
SCHEMBL490622 0.63 ACHE (0.32) ACHEGSK3BCYP2D6TSHRKDM2B
Acrylic Acid SCHEMBL31621895 0.61 LMNA (0.71) AKT1TSHRALDH1A1
Acrylic Acid SCHEMBL2810492 0.61
SCHEMBL14032031 0.61 CYP2D6 (0.34) ACHEGSK3BCYP2D6TSHR
SCHEMBL17226145 0.61 CYP2D6 (0.31) ACHECYP2D6TSHR
SCHEMBL10697553 0.60 MAPT (0.59) AKT1ALDH5A1ABATTHRBTHRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269187-B1 AMPHIPHATIC POLYMERIZABLE VINYL MONOMERS, VINYL RESIN PARTICLES DERIVED FROM SAID MONOMERS AND PREPARATION THEREOF Nippon Paint Co., Ltd. (JP) 1992-01-29 EP disclosed
US-5017646-A Paints NIPPON PAINT CO., LTD. (JP) 1991-05-21 US disclosed
EP-0231038-B1 VINYL RESIN MICROPARTICLES AND AQUEOUS EMULSION CONTAINING THE SAME Nippon Paint Co., Ltd. (JP) 1991-05-15 EP disclosed
US-4908468-A Amphiphatic polymerizable vinyl monomers, vinyl resin particles derived from said monomers and preparation thereof NIPPON PAINT CO., LTD. (JP) 1990-03-13 US disclosed
EP-0231038-A1 Vinyl resin microparticles and aqueous emulsion containing the same Nippon Paint Co., Ltd. (JP) 1987-08-05 EP disclosed