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BDBM44578 1-(5-bromanylthiophen-2-yl)sulfonyl-4-methyl-piperidine::1-(5-bromothiophen-2-yl)sulfonyl-4-methylpiperidine::1-[(5-bromo-2-thienyl)sulfonyl]-4-methyl-piperidine::1-[(5-bromo-2-thienyl)sulfonyl]-4-methylpiperidine::1-[(5-bromo-2-thiophenyl)sulfonyl]-4-methylpiperidine::FLURANDRENOLIDE::MLS000069556::MLS000099277::SMR000058825::SMR000073540::cid_15209::cid_893468

SMILES: CC1CCN(CC1)S(=O)(=O)c1ccc(Br)s1

InChI Key: InChIKey=CHEPIYWIJYHOPN-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 = 44578   
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
Multidrug resistance protein 1/Multidrug resistance associated protein 1


(Homo sapiens (Human))
BDBM44578
PNG
(1-(5-bromanylthiophen-2-yl)sulfonyl-4-methyl-piper...)
Show SMILES CC1CCN(CC1)S(=O)(=O)c1ccc(Br)s1
Show InChI InChI=1S/C10H14BrNO2S2/c1-8-4-6-12(7-5-8)16(13,14)10-3-2-9(11)15-10/h2-3,8H,4-7H2,1H3
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n/an/an/an/a 3.52E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q25719FH
More data for this
Ligand-Target Pair
transient receptor potential cation channel, subfamily N, member 1


(Danio rerio)
BDBM44578
PNG
(1-(5-bromanylthiophen-2-yl)sulfonyl-4-methyl-piper...)
Show SMILES CC1CCN(CC1)S(=O)(=O)c1ccc(Br)s1
Show InChI InChI=1S/C10H14BrNO2S2/c1-8-4-6-12(7-5-8)16(13,14)10-3-2-9(11)15-10/h2-3,8H,4-7H2,1H3
KEGG

UniProtKB/TrEMBL

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n/an/an/an/a 2.99E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2Z60MG3
More data for this
Ligand-Target Pair
MCOLN3 protein


(Homo sapiens (Human))
BDBM44578
PNG
(1-(5-bromanylthiophen-2-yl)sulfonyl-4-methyl-piper...)
Show SMILES CC1CCN(CC1)S(=O)(=O)c1ccc(Br)s1
Show InChI InChI=1S/C10H14BrNO2S2/c1-8-4-6-12(7-5-8)16(13,14)10-3-2-9(11)15-10/h2-3,8H,4-7H2,1H3
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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a>2.99E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q21834W4
More data for this
Ligand-Target Pair