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BDBM64832 3-(2-methylphenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide::3-(2-methylphenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]propionamide::MLS-0213188.0001::cid_5031770

SMILES: Cc1ccccc1OCCC(=O)NCCc1ccc(cc1)S(N)(=O)=O

InChI Key: InChIKey=NWRXGZDSFIRHIW-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 64832   
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
Nucleotide-binding oligomerization domain-containing protein 1


(Homo sapiens (Human))
BDBM64832
PNG
(3-(2-methylphenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]...)
Show SMILES Cc1ccccc1OCCC(=O)NCCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C18H22N2O4S/c1-14-4-2-3-5-17(14)24-13-11-18(21)20-12-10-15-6-8-16(9-7-15)25(19,22)23/h2-9H,10-13H2,1H3,(H,20,21)(H2,19,22,23)
PDB
MMDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>3.20E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2F47MKR
More data for this
Ligand-Target Pair
G-protein coupled receptor 55


(Homo sapiens (Human))
BDBM64832
PNG
(3-(2-methylphenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]...)
Show SMILES Cc1ccccc1OCCC(=O)NCCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C18H22N2O4S/c1-14-4-2-3-5-17(14)24-13-11-18(21)20-12-10-15-6-8-16(9-7-15)25(19,22)23/h2-9H,10-13H2,1H3,(H,20,21)(H2,19,22,23)
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>3.20E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics(SSBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2028PZ5
More data for this
Ligand-Target Pair