Cetrimonium

Cetrimonium

SCHEMBL584088

CCCCCCCC/C=C\CCCCCCCCCCCC[N+](C)(C)C.CCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-].[Cl-]

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Cetrimonium. 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
ACHE known ✓ P22303 2/20 0.50
DNM1 Q05193 6/20 0.73
APAF1 O14727 1/20 0.62
HSP90AA1 P07900 1/20 0.62
RAD52 P43351 1/20 0.62
ENPP2 Q13822 1/20 0.55
APEX1 P27695 3/20 0.55
NPSR1 Q6W5P4 1/20 0.55
FAAH O00519 2/20 0.52
TRPV1 Q8NER1 1/20 0.52
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
NFKB1 P19838 2/20 0.50
KDM4E B2RXH2 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
PMP22 Q01453 2/20 0.50
LMNA P02545 1/20 0.50
HSD17B10 Q99714 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
TSHR P16473 1/20 0.50

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
Hydrochloric Acid SCHEMBL8660656 1.00 DNM1 (0.73) DNM1APAF1HSP90AA1RAD52ENPP2
Cetrimonium SCHEMBL584090 1.00 DNM1 (0.73) DNM1APAF1HSP90AA1RAD52ENPP2
Hydrochloric Acid SCHEMBL313869 1.00 DNM1 (0.73) DNM1APAF1HSP90AA1RAD52ENPP2
Hydrochloric Acid SCHEMBL1029164 1.00 DNM1 (0.73) DNM1APAF1HSP90AA1RAD52ENPP2
Hydrochloric Acid SCHEMBL1029166 1.00 DNM1 (0.73) DNM1APAF1HSP90AA1RAD52ENPP2
Hydrochloric Acid SCHEMBL313867 1.00 DNM1 (0.73) DNM1APAF1HSP90AA1RAD52ENPP2
SCHEMBL3802505 0.98 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52ENPP2
SCHEMBL4047250 0.98 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52ENPP2
SCHEMBL6549116 0.98 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52ENPP2
SCHEMBL157763 0.98 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11929257-B2 Etching solution and method for aluminum nitride VERSUM MATERIALS US, LLC (US) 2024-03-12 US claimed
US-20220367199-A1 ETCHING SOLUTION AND METHOD FOR ALUMINUM NITRIDE VERSUM MATERIALS US, LLC (US) 2022-11-17 US claimed
EP-3959291-A1 ETCHING SOLUTION AND METHOD FOR ALUMINUM NITRIDE Versum Materials US, LLC (US) 2022-03-02 EP claimed
WO-2020185745-A1 ETCHING SOLUTION AND METHOD FOR ALUMINUM NITRIDE VERSUM MATERIALS US, LLC (US) 2020-09-17 WO claimed
US-9315712-B2 Viscoelastic surfactants and methods of making and using same HALLIBURTON ENERGY SERVICES, INC. (US) 2016-04-19 US claimed
EP-2519600-A1 COMPRESSIBLE PACKER FLUIDS AND METHODS OF MAKING AND USING SAME Halliburton Energy Services, Inc. (US) 2012-11-07 EP claimed
US-8207096-B2 Compressible packer fluids and methods of making and using same HALLIBURTON ENERGY SERVICES INC. (US) 2012-06-26 US claimed
EP-2417212-A1 VISCOELASTIC SURFACTANTS AND METHODS OF MAKING AND USING SAME Halliburton Energy Services, Inc. (US) 2012-02-15 EP claimed
WO-2011080506-A1 COMPRESSIBLE PACKER FLUIDS AND METHODS OF MAKING AND USING SAME HALLIBURTON ENERGY SERVICES, INC. (US) 2011-07-07 WO claimed
US-20110160103-A1 Compressible Packer Fluids and Methods of Making and Using Same HALLIBURTON ENERGY SERVICES, INC (US) 2011-06-30 US claimed
WO-2010116117-A1 VISCOELASTIC SURFACTANTS AND METHODS OF MAKING AND USING SAME HALLIBURTON ENERGY SERVICES, INC. (US) 2010-10-14 WO claimed
US-20100256025-A1 Viscoelastic surfactants and methods of making and using same HALLIBURTON ENERGY SERVICES, INC, (US) 2010-10-07 US claimed
US-11929257-B2 Etching solution and method for aluminum nitride VERSUM MATERIALS US, LLC (US) 2024-03-12 US disclosed
US-11873448-B2 Wellbore servicing fluid and methods of making and using same HALLIBURTON ENERGY SERVICES, INC. (US) 2024-01-16 US disclosed
US-20230151267-A1 WELLBORE SERVICING FLUID AND METHODS OF MAKING AND USING SAME HALLIBURTON ENERGY SERVICES, INC. 2023-05-18 US disclosed
US-20220367199-A1 ETCHING SOLUTION AND METHOD FOR ALUMINUM NITRIDE VERSUM MATERIALS US, LLC (US) 2022-11-17 US disclosed
WO-2020185745-A1 ETCHING SOLUTION AND METHOD FOR ALUMINUM NITRIDE VERSUM MATERIALS US, LLC (US) 2020-09-17 WO disclosed
US-10344197-B2 Systems and methods for analyzing the characteristics and compositions of cement additives HALLIBURTON ENERGY SERVICES, INC. (US) 2019-07-09 US disclosed
US-20170190946-A1 Systems And Methods For Analyzing The Characteristics And Compositions Of Cement Additives HALLIBURTON ENERGY SERVICES, INC. (US) 2017-07-06 US disclosed
WO-2016032438-A1 SYSTEMS AND METHODS FOR ANALYZING THE CHARACTERISTICS AND COMPOSITIONS OF CEMENT ADDITIVES HALLIBURTON ENERGY SERVICES, INC. (US) 2016-03-03 WO disclosed