Trimethylammonium

Trimethylammonium

SCHEMBL7090073

CN(C)C.COc1ccccc1N=Nc1c(O)ccc2ccccc12

nearest known ligand 0.58

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.58
L3MBTL1 Q9Y468 6/20 0.58
NPC1 O15118 3/20 0.58
MAPK1 P28482 3/20 0.58
KDM4E B2RXH2 2/20 0.58
THRB P10828 3/20 0.53
TDP1 Q9NUW8 4/20 0.51
HSP90AA1 P07900 3/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
NSD2 O96028 1/20 0.51
CASP6 P55212 1/20 0.51
LMNA P02545 2/20 0.50
ALPL P05186 2/20 0.50
ALPG P10696 2/20 0.50
ALPI P09923 1/20 0.50
GAA P10253 1/20 0.50
CASP3 P42574 1/20 0.50
RECQL P46063 1/20 0.50
MMP14 P50281 1/20 0.50

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
SCHEMBL30688251 0.96 MAPT (0.62) MAPTL3MBTL1NPC1MAPK1KDM4E
SCHEMBL29376206 0.96 MAPT (0.62) MAPTL3MBTL1NPC1MAPK1KDM4E
SCHEMBL31011001 0.96 MAPT (0.62) MAPTL3MBTL1NPC1MAPK1KDM4E
SCHEMBL3074025 0.96 MAPT (0.62) MAPTL3MBTL1NPC1MAPK1KDM4E
SCHEMBL1507672 0.96 MAPT (0.62) MAPTL3MBTL1NPC1MAPK1KDM4E
SCHEMBL16220649 0.86 KMT2A (0.45) MAPTL3MBTL1NPC1MAPK1KDM4E
SCHEMBL17355507 0.86 KMT2A (0.45) MAPTL3MBTL1NPC1MAPK1KDM4E
Hydrochloric Acid SCHEMBL28021015 0.85 KMT2A (0.44) MAPTL3MBTL1NPC1MAPK1KDM4E
SCHEMBL10087015 0.83 THRB (0.59) MAPTL3MBTL1NPC1MAPK1KDM4E
SCHEMBL16063029 0.83 THRB (0.59) MAPTL3MBTL1NPC1MAPK1KDM4E

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-0843993-B1 Composition and process for dyeing hair WELLA AG (DE) 2003-08-06 EP claimed
EP-0843994-B1 Composition and process for dyeing hair WELLA AG (DE) 2003-08-06 EP claimed
CN-1191050-C Application of two kinds of cationic dye mixture in direct dyeing of keratin fiber OREAL (FR) 2005-03-02 CN disclosed
CN-1265307-A Application of two kinds of cationic dye mixture in direct dyeing of keratin fiber OREAL (FR) 2000-09-06 CN disclosed