Tetrapropylammonium

Tetrapropylammonium

SCHEMBL105473

CCC[N+](CCC)(CCC)CCC.CCC[N+](CCC)(CCC)CCC.O=C([O-])/C=C/C(=O)[O-]

nearest known ligand 0.50

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Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol

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

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.50
BBOX1 O75936 2/20 0.43
FFAR3 O14843 2/20 0.36
HDAC3 O15379 2/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC2 Q92769 2/20 0.36
HDAC8 Q9BY41 2/20 0.36
CES2 O00748 2/20 0.35
CES1 P23141 2/20 0.35
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
FABP3 P05413 2/20 0.33
SLC22A2 O15244 1/20 0.33

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
Tetrapropylammonium SCHEMBL107831 1.00 SLC22A1 (0.50) SLC22A1BBOX1FFAR3HDAC3HDAC1
Tetrapropylammonium SCHEMBL106232 1.00 SLC22A1 (0.50) SLC22A1BBOX1FFAR3HDAC3HDAC1
Tetrapropylammonium SCHEMBL2347035 0.98 SLC22A1 (0.48) SLC22A1BBOX1FFAR3HDAC3HDAC1
Tetrapropylammonium SCHEMBL2352022 0.98 SLC22A1 (0.48) SLC22A1BBOX1FFAR3HDAC3HDAC1
Tetrapropylammonium SCHEMBL2347044 0.98 SLC22A1 (0.48) SLC22A1BBOX1FFAR3HDAC3HDAC1
Fumaric Acid SCHEMBL2354659 0.91 SLC22A1 (0.42) SLC22A1BBOX1FFAR3HDAC3HDAC1
Tetrapropylammonium SCHEMBL28970865 0.91 SLC22A1 (0.42) SLC22A1BBOX1
Fumaric Acid SCHEMBL2354666 0.91 SLC22A1 (0.42) SLC22A1BBOX1FFAR3HDAC3HDAC1
Tetrapropylammonium SCHEMBL106231 0.91 SLC22A1 (0.42) SLC22A1BBOX1
Tetrapropylammonium SCHEMBL2348766 0.91 SLC22A1 (0.42) SLC22A1BBOX1

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 162 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3481878-B1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2024-05-22 EP claimed
CN-109476803-B Amine compositions useful for making polyurethane foams 赢创运营有限公司 2022-04-12 CN claimed
US-11021561-B2 Amine composition useful for making polyurethane foam EVONIK OPERATIONS GMBH (DE) 2021-06-01 US claimed
EP-3144332-B1 NEW TRIMER CATALYST ADDITIVES FOR IMPROVING FOAM PROCESSABILITY EVONIK OPERATIONS GMBH (DE) 2020-10-21 EP claimed
EP-3481878-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM Evonik Degussa GmbH (DE) 2019-05-15 EP claimed
US-9878318-B2 Trimer catalyst additives for improving foam processability EVONIK DEGUSSA GMBH (DE) 2018-01-30 US claimed
WO-2018013590-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK DEGUSSA GMBH (DE) 2018-01-18 WO claimed
US-20180009930-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2018-01-11 US claimed
US-9815932-B2 Trimer catalysts with improved processability and surface cure EVONIK DEGUSSA GMBH (DE) 2017-11-14 US claimed
EP-3144332-A1 NEW TRIMER CATALYST ADDITIVES FOR IMPROVING FOAM PROCESSABILITY AIR PRODUCTS AND CHEMICALS, INC. (US) 2017-03-22 EP claimed
US-20140042361-A1 TRIMER CATALYSTS WITH IMPROVED PROCESSABILITY AND SURFACE CURE EVONIK OPERATIONS GMBH (DE) 2014-02-13 US claimed
US-20140005037-A1 TRIMER CATALYST ADDITIVES FOR IMPROVING FOAM PROCESSABILITY EVONIK OPERATIONS GMBH (DE) 2014-01-02 US claimed
US-8580864-B2 Trimer catalysts with improved processability and surface cure AIR PRODUCTS AND CHEMICALS, INC. (US) 2013-11-12 US claimed
US-8552077-B2 Trimer catalyst additives for improving foam processability AIR PRODUCTS AND CHEMICALS, INC. (US) 2013-10-08 US claimed
US-20080312351-A1 Tetraalkylammonium Carboxylate Salts as Trimerization Catalysts for Spray Foam Applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2008-12-18 US claimed
EP-2003157-A2 Tetraalkylammonium carboxylate salts as trimerization catalysts for spray foam applications Air Products and Chemicals, Inc. (US) 2008-12-17 EP claimed
US-20070259773-A1 Trimer catalyst additives for improving foam processability EVONIK OPERATIONS GMBH (DE) 2007-11-08 US claimed
US-20070259982-A1 Trimer catalysts with improved processability and surface cure EVONIK OPERATIONS GMBH (DE) 2007-11-08 US claimed
EP-1852449-A2 New trimer catalyst with improved processability and surface cure Air Products and Chemicals, Inc. (US) 2007-11-07 EP claimed
EP-1852450-A2 New trimer catalyst additives for improving foam processability Air Products and Chemicals, Inc. (US) 2007-11-07 EP claimed