Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL6697439

CC(I)(C(=O)O)C(=O)O.CCCC[N+](CCCC)(CCCC)CCCC.[I-]

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG

The experimentally established mechanism targets of Tetrabuthylammonium. 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
SLC22A1 O15245 3/20 0.48
SLC22A2 O15244 1/20 0.42
TSHR P16473 4/20 0.39
ALDH1A1 P00352 3/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX12 P18054 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
DNM1 Q05193 2/20 0.37
AKR1B1 P15121 1/20 0.37
PPARG P37231 5/20 0.35
PPARD Q03181 5/20 0.35
PPARA Q07869 5/20 0.35
HDAC11 Q96DB2 4/20 0.35
GPR84 Q9NQS5 3/20 0.35
TLR2 O60603 2/20 0.35
TDP1 Q9NUW8 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 SCHEMBL2354515 0.83 SLC22A1 (0.57) SLC22A1SLC22A2TSHRALDH1A1ALOX15
Tetrabuthylammonium SCHEMBL107484 0.81 SLC22A1 (0.55) SLC22A1SLC22A2TSHRALDH1A1ALOX15
Tetrabuthylammonium SCHEMBL109268 0.78 SLC22A1 (0.71) SLC22A1SLC22A2TSHRALDH1A1ALOX15
Tetrabuthylammonium SCHEMBL29047726 0.78 SLC22A1 (0.71) SLC22A1SLC22A2TSHRALDH1A1ALOX15
Pivalate SCHEMBL8873099 0.77 SLC22A1 (0.59) SLC22A1SLC22A2TSHRALDH1A1ALOX15
Tetrabuthylammonium SCHEMBL17353521 0.77 SLC22A1 (0.55) SLC22A1SLC22A2TSHRALDH1A1ALOX15
Tetrabuthylammonium SCHEMBL16343544 0.75 SLC22A1 (0.67) SLC22A1SLC22A2TSHRALDH1A1ALOX15
Tetrabuthylammonium SCHEMBL21372576 0.75 SLC22A1 (0.67) SLC22A1SLC22A2TSHRALDH1A1ALOX15
Tetrabuthylammonium SCHEMBL6356120 0.75 SLC22A1 (0.67) SLC22A1SLC22A2TSHRALDH1A1ALOX15
Tetrabuthylammonium SCHEMBL29241995 0.75 SLC22A1 (0.67) SLC22A1SLC22A2TSHRALDH1A1ALOX15

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
US-6756457-B2 POLYMERIZING VINYL MONOMERS IN PRESENCE OF INITIATING SYSTEM COMPRISING ORGANIC SULFUR COMPOUND AND ONIUM SALT CATALYST EASTMAN KODAK COMPANY 2004-06-29 US disclosed
US-6737486-B2 USING ORGANIC HALIDE OR SULFUR INITIATOR; MAINTAINING PROCESS CONTROL AND UNIFORMITY EASTMAN KODAK COMPANY 2004-05-18 US disclosed
US-20040014919-A1 Novel polymerization process EASTMAN KODAK COMPANY 2004-01-22 US disclosed
US-20040014910-A1 Novel polymerization process EASTMAN KODAK COMPANY 2004-01-22 US disclosed
US-6310165-B1 VINYL MONOMER WITH ONIUM SALT TRANSITION METAL CAYALYST EASTMAN KODAK COMPANY 2001-10-30 US disclosed
US-6306995-B1 CATALYTIC POLYMERIZATION WITH ONIUM CATALYSTS EASTMAN KODAK COMPANY 2001-10-23 US disclosed