Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL7890102

CC(C)(C)c1ccc([O-])cc1.CCCC[N+](CCCC)(CCCC)CCCC

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.44
HDAC3 O15379 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
SLC22A2 O15244 1/20 0.39
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
ALOX12 P18054 1/20 0.37
HIF1A Q16665 1/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 2/20 0.35

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
Tetrabuthylammonium SCHEMBL4938830 0.84 SLC22A1 (0.43) SLC22A1HDAC3HDAC1HDAC2SLC22A2
Tetrabuthylammonium SCHEMBL28413492 0.81 LMNA (0.59) SLC22A1HDAC3HDAC1HDAC2HDAC8
Tetrabuthylammonium SCHEMBL30595677 0.80 LMNA (0.40) SLC22A1HDAC3HDAC1HDAC2SLC22A2
Tetrabuthylammonium SCHEMBL6431277 0.79 SLC22A1 (0.50) SLC22A1SLC22A2ALDH1A1SMN1; SMN2TSHR
Tetrabuthylammonium SCHEMBL106868 0.78 HDAC1 (0.51) SLC22A1HDAC3HDAC1HDAC2HDAC8
Tetrabuthylammonium SCHEMBL29130225 0.77 LMNA (0.48) HDAC3HDAC1HDAC2HDAC8HDAC6
Tetrabuthylammonium SCHEMBL11884927 0.77 SLC22A1 (0.48) SLC22A1SLC22A2ALDH1A1SMN1; SMN2TSHR
Tetrabuthylammonium SCHEMBL28464494 0.77 SLC22A1 (0.48) SLC22A1SLC22A2ALDH1A1SMN1; SMN2TSHR
Tetrabuthylammonium SCHEMBL887137 0.76 SLC22A1 (0.52) SLC22A1SLC22A2ALDH1A1SMN1; SMN2TSHR
Tetrabuthylammonium SCHEMBL3062586 0.76 SLC22A1 (0.39) SLC22A1HDAC3HDAC1HDAC2SLC22A2

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
US-6177538-B1 Method for producing tetrabutyl ammonium phenolate diphenol adduct BAYER AKTIENGESELLSCHAFT (DE) 2001-01-23 US disclosed