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BDBM38882 MLS000079343::N-(2,5-dimethoxyphenyl)-4-(2-ketopyrrolidino)benzenesulfonamide::N-(2,5-dimethoxyphenyl)-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide::N-(2,5-dimethoxyphenyl)-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide::N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide::SMR000038206::cid_658276

SMILES: COc1ccc(OC)c(NS(=O)(=O)c2ccc(cc2)N2CCCC2=O)c1

InChI Key: InChIKey=DUIMJHGQWFVERX-UHFFFAOYSA-N

Data: 2 IC50  1 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 = 38882   
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
Nuclear receptor ROR-alpha


(Homo sapiens (Human))
BDBM38882
PNG
(MLS000079343 | N-(2,5-dimethoxyphenyl)-4-(2-ketopy...)
Show SMILES COc1ccc(OC)c(NS(=O)(=O)c2ccc(cc2)N2CCCC2=O)c1
Show InChI InChI=1S/C18H20N2O5S/c1-24-14-7-10-17(25-2)16(12-14)19-26(22,23)15-8-5-13(6-9-15)20-11-3-4-18(20)21/h5-10,12,19H,3-4,11H2,1-2H3
PDB
MMDB

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B.MOAD
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PC cid
PC sid
UniChem
Article
PCBioAssay
n/an/a 3.48E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


Article DOI: 10.1021/cc0600021
More data for this
Ligand-Target Pair
High-affinity choline transporter


(Homo sapiens (Human))
BDBM38882
PNG
(MLS000079343 | N-(2,5-dimethoxyphenyl)-4-(2-ketopy...)
Show SMILES COc1ccc(OC)c(NS(=O)(=O)c2ccc(cc2)N2CCCC2=O)c1
Show InChI InChI=1S/C18H20N2O5S/c1-24-14-7-10-17(25-2)16(12-14)19-26(22,23)15-8-5-13(6-9-15)20-11-3-4-18(20)21/h5-10,12,19H,3-4,11H2,1-2H3
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UniProtKB/SwissProt

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PC sid
UniChem
PCBioAssay
n/an/an/an/a 2.22E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
Data Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center Affiliation: Johns Hopkins University, School of Medicine Screening ...


PubChem Bioassay (2012)

More data for this
Ligand-Target Pair
Steroidogenic Factor 1


(Homo sapiens (Human))
BDBM38882
PNG
(MLS000079343 | N-(2,5-dimethoxyphenyl)-4-(2-ketopy...)
Show SMILES COc1ccc(OC)c(NS(=O)(=O)c2ccc(cc2)N2CCCC2=O)c1
Show InChI InChI=1S/C18H20N2O5S/c1-24-14-7-10-17(25-2)16(12-14)19-26(22,23)15-8-5-13(6-9-15)20-11-3-4-18(20)21/h5-10,12,19H,3-4,11H2,1-2H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem
Article
PCBioAssay
n/an/a 3.60E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


Article DOI: 10.1021/cc060110n
More data for this
Ligand-Target Pair