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BDBM43921 MLS000033642::N,N-Dimethyl-3-[4-(5-methyl-benzotriazol-1-yl)-piperidine-1-sulfonyl]-benzenesulfonamide::N,N-dimethyl-3-[4-(5-methylbenzotriazol-1-yl)piperidin-1-yl]sulfonyl-benzenesulfonamide::N,N-dimethyl-3-[4-(5-methylbenzotriazol-1-yl)piperidin-1-yl]sulfonylbenzenesulfonamide::N,N-dimethyl-3-[4-(5-methylbenzotriazol-1-yl)piperidino]sulfonyl-benzenesulfonamide::N,N-dimethyl-3-[[4-(5-methyl-1-benzotriazolyl)-1-piperidinyl]sulfonyl]benzenesulfonamide::SMR000006493::cid_650808

SMILES: CN(C)S(=O)(=O)c1cccc(c1)S(=O)(=O)N1CCC(CC1)n1nnc2cc(C)ccc12

InChI Key: InChIKey=MBHLUKQUZFDHDI-UHFFFAOYSA-N

Data: 3 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 43921   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Solute carrier family 12 member 5


(Homo sapiens (Human))
BDBM43921
PNG
(MLS000033642 | N,N-Dimethyl-3-[4-(5-methyl-benzotr...)
Show SMILES CN(C)S(=O)(=O)c1cccc(c1)S(=O)(=O)N1CCC(CC1)n1nnc2cc(C)ccc12
Show InChI InChI=1S/C20H25N5O4S2/c1-15-7-8-20-19(13-15)21-22-25(20)16-9-11-24(12-10-16)31(28,29)18-6-4-5-17(14-18)30(26,27)23(2)3/h4-8,13-14,16H,9-12H2,1-3H3
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 3.38E+3n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2TX3CSC
More data for this
Ligand-Target Pair
Solute carrier family 12 member 5


(Homo sapiens (Human))
BDBM43921
PNG
(MLS000033642 | N,N-Dimethyl-3-[4-(5-methyl-benzotr...)
Show SMILES CN(C)S(=O)(=O)c1cccc(c1)S(=O)(=O)N1CCC(CC1)n1nnc2cc(C)ccc12
Show InChI InChI=1S/C20H25N5O4S2/c1-15-7-8-20-19(13-15)21-22-25(20)16-9-11-24(12-10-16)31(28,29)18-6-4-5-17(14-18)30(26,27)23(2)3/h4-8,13-14,16H,9-12H2,1-3H3
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PC cid
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PCBioAssay
n/an/an/an/a 6.91E+3n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2M32T6M
More data for this
Ligand-Target Pair
Solute carrier family 12 member 5


(Homo sapiens (Human))
BDBM43921
PNG
(MLS000033642 | N,N-Dimethyl-3-[4-(5-methyl-benzotr...)
Show SMILES CN(C)S(=O)(=O)c1cccc(c1)S(=O)(=O)N1CCC(CC1)n1nnc2cc(C)ccc12
Show InChI InChI=1S/C20H25N5O4S2/c1-15-7-8-20-19(13-15)21-22-25(20)16-9-11-24(12-10-16)31(28,29)18-6-4-5-17(14-18)30(26,27)23(2)3/h4-8,13-14,16H,9-12H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a 4.09E+3n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2Q52N1X
More data for this
Ligand-Target Pair