Tributylmethylammonium

Tributylmethylammonium

SCHEMBL1969906

CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.CCCC[N+](C)(CCCC)CCCC.O=P([O-])([O-])F.O=P([O-])([O-])F.O=P([O-])([O-])F.O=P([O-])([O-])F.O=P([O-])([O-])F.O=P([O-])([O-])F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
ESR1 P03372 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
CDC25A P30304 1/20 0.40
AGTR1 P30556 1/20 0.40
AKT1 P31749 1/20 0.40
ADRA1A P35348 1/20 0.40
KCNH2 Q12809 1/20 0.40
SLC22A1 O15245 2/20 0.38
DNM1 Q05193 8/20 0.37
LSS P48449 1/20 0.36
FAAH O00519 1/20 0.34
BBOX1 O75936 1/20 0.34
HTT P42858 1/20 0.33
SLC22A2 O15244 1/20 0.32

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
Tributylmethylammonium SCHEMBL12816054 0.93 LMNA (0.44) LMNAESR1ADORA3CDC25AAGTR1
Tributylmethylammonium SCHEMBL14777172 0.88 BBOX1 (0.45) LMNAESR1ADORA3CDC25AAGTR1
Phosphoric Acid SCHEMBL30818476 0.86 DNM1 (0.54) LMNAESR1ADORA3CDC25AAGTR1
Phosphoric Acid SCHEMBL29166696 0.86 DNM1 (0.54) LMNAESR1ADORA3CDC25AAGTR1
Phosphoric Acid SCHEMBL29166411 0.86 DNM1 (0.54) LMNAESR1ADORA3CDC25AAGTR1
Phosphoric Acid SCHEMBL29166640 0.86 DNM1 (0.54) LMNAESR1ADORA3CDC25AAGTR1
Tetrabuthylammonium SCHEMBL4652889 0.83 SLC22A1 (0.60) LMNAESR1ADORA3CDC25AAGTR1
Tetrabuthylammonium SCHEMBL10933481 0.83 SLC22A1 (0.60) LMNAESR1ADORA3CDC25AAGTR1
Tetrabuthylammonium SCHEMBL7800475 0.83 SLC22A1 (0.60) LMNAESR1ADORA3CDC25AAGTR1
Phosphoric Acid SCHEMBL18298168 0.83 LSS (0.54) LMNAESR1ADORA3CDC25AAGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1505057-B1 METHOD OF PURIFYING QUATERNARY ALKYLAMMONIUM SALT STELLA CHEMIFA KABUSHIKI KAISHA (JP) 2011-06-22 EP disclosed