Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL15416488

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.O=S(=O)([O-])CS(=O)(=O)[O-]

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.57
TSHR P16473 2/20 0.52
ALDH1A1 P00352 1/20 0.52
TP53 P04637 1/20 0.52
CYP3A4 P08684 1/20 0.52
ALOX15 P16050 1/20 0.52
ALOX12 P18054 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HIF1A Q16665 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SLC22A2 O15244 1/20 0.50
DNM1 Q05193 5/20 0.48
RECQL P46063 2/20 0.43
GLA P06280 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
EPHX2 P34913 1/20 0.43
BLM P54132 1/20 0.43
LSS P48449 1/20 0.41

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
SCHEMBL330864 0.91 SLC22A1 (0.62) SLC22A1TSHRALDH1A1TP53CYP3A4
Tetrabuthylammonium SCHEMBL331003 0.90 SLC22A1 (0.63) SLC22A1TSHRALDH1A1TP53CYP3A4
Tetrahexylammonium SCHEMBL330969 0.88 SLC22A1 (0.65) SLC22A1TSHRALDH1A1TP53CYP3A4
SCHEMBL331695 0.88 SLC22A1 (0.65) SLC22A1TSHRALDH1A1TP53CYP3A4
SCHEMBL330481 0.88 SLC22A1 (0.65) SLC22A1TSHRALDH1A1TP53CYP3A4
Tetrabuthylammonium SCHEMBL243898 0.87 SLC22A1 (0.67) SLC22A1TSHRALDH1A1TP53CYP3A4
Tetrabuthylammonium SCHEMBL31179786 0.86 SLC22A1 (0.52) SLC22A1TSHRALDH1A1TP53CYP3A4
Tetrabuthylammonium SCHEMBL28755552 0.86 SLC22A1 (0.52) SLC22A1TSHRALDH1A1TP53CYP3A4
Tetrabuthylammonium SCHEMBL31179740 0.86 SLC22A1 (0.52) SLC22A1TSHRALDH1A1TP53CYP3A4
Tetrabuthylammonium SCHEMBL31179762 0.86 SLC22A1 (0.52) SLC22A1TSHRALDH1A1TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3259055-B1 CO2 SORPTION BY SUPPORTED AMINO ACID IONIC LIQUIDS DANMARKS TEKNISKE UNIV DTU (DK) 2019-01-23 EP disclosed
US-10130911-B2 CO2 sorption by supported amino acid ionic liquids DANMARKS TEKNISKE UNIVERSITET (DK) 2018-11-20 US disclosed
EP-3259055-A1 CO2 SORPTION BY SUPPORTED AMINO ACID IONIC LIQUIDS Danmarks Tekniske Universitet (DTU) (DK) 2017-12-27 EP disclosed
US-20170173523-A1 CO2 SORPTION BY SUPPORTED AMINO ACID IONIC LIQUIDS DANMARKS TEKNISKE UNIVERSITET (DK) 2017-06-22 US disclosed
US-20150196895-A1 CO2 SORPTION BY SUPPORTED AMINO ACID IONIC LIQUIDS DANMARKS TEKNISKE UNIVERSITET (DK) 2015-07-16 US disclosed
WO-2014009533-A1 CO2 SORPTION BY SUPPORTED AMINO ACID IONIC LIQUIDS DANMARKS TEKNISKE UNIVERSITET (DK) 2014-01-16 WO disclosed