Dimethylamine

Dimethylamine

SCHEMBL6289518

CNC.C[S+](C)CC(=O)c1ccccc1.[Br-]

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

The experimentally established mechanism targets of Dimethylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
MEN1 O00255 2/20 0.54
MAPK1 P28482 2/20 0.54
CYP3A4 P08684 2/20 0.54
HPGD P15428 2/20 0.54
MAPT P10636 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
KDM4E B2RXH2 1/20 0.54
ALOX15 P16050 1/20 0.54
CES1 P23141 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
PTPN1 P18031 2/20 0.47
ERCC5 P28715 1/20 0.47
FEN1 P39748 1/20 0.47
ALDH1A1 P00352 3/20 0.45
GSK3B P49841 2/20 0.45
HIF1A Q16665 2/20 0.45
TRPA1 O75762 1/20 0.45

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
Bromide SCHEMBL394250 0.94 KMT2A (0.54) KMT2AMEN1MAPK1CYP3A4HPGD
SCHEMBL686321 0.92 KMT2A (0.56) KMT2AMEN1MAPK1CYP3A4HPGD
Hydrochloric Acid SCHEMBL60929 0.90 KMT2A (0.54) KMT2AMEN1MAPK1CYP3A4HPGD
Diethylamine SCHEMBL6289059 0.87 KMT2A (0.48) KMT2AMEN1MAPK1CYP3A4HPGD
SCHEMBL30112595 0.85 KMT2A (0.48) KMT2AMEN1MAPK1CYP3A4HPGD
SCHEMBL394058 0.85 MAPT (0.48) KMT2AMEN1MAPK1CYP3A4HPGD
SCHEMBL10405142 0.81 LMNA (0.46) KMT2AMEN1MAPK1CYP3A4HPGD
SCHEMBL8150640 0.81 MAPT (0.45) KMT2AMEN1MAPK1CYP3A4HPGD
Dimethylamine SCHEMBL6289065 0.81 HPGD (0.49) KMT2AMEN1HPGDMAPTTDP1
SCHEMBL565176 0.79 MAPT (0.56) KMT2AMEN1MAPK1CYP3A4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6900250-B2 Polymerizable composition TOYO INK MFG. CO., LTD. (JP) 2005-05-31 US disclosed
US-20030212162-A1 Photopolymerization using photoinitiators TOYO INK MFG. CO., LTD. (JP) 2003-11-13 US disclosed