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BDBM42334 MLS000047486::N-(3,4-dimethoxyphenyl)-2-(4-p-cumenylsulfonylpiperazino)acetamide::N-(3,4-dimethoxyphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]acetamide::N-(3,4-dimethoxyphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]acetamide::N-(3,4-dimethoxyphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide::N-(3,4-dimethoxyphenyl)-2-{4-[(4-isopropylphenyl)sulfonyl]piperazin-1-yl}acetamide::SMR000033497::cid_3238707

SMILES: COc1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccc(cc2)C(C)C)cc1OC

InChI Key: InChIKey=CQOVPDOZPIPSDJ-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 42334   
Target
(Institution)
LigandTarget
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
Glucocerebrosidase (Acid beta-Glucosidase)


(Homo sapiens (human))
BDBM42334
PNG
(MLS000047486 | N-(3,4-dimethoxyphenyl)-2-(4-p-cume...)
Show SMILES COc1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccc(cc2)C(C)C)cc1OC
Show InChI InChI=1S/C23H31N3O5S/c1-17(2)18-5-8-20(9-6-18)32(28,29)26-13-11-25(12-14-26)16-23(27)24-19-7-10-21(30-3)22(15-19)31-4/h5-10,15,17H,11-14,16H2,1-4H3,(H,24,27)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
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AffyNet 
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PC cid
PC sid
UniChem

Similars

AffyNet 
PCBioAssay
n/an/an/an/a>1.00E+4n/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 (2008)

More data for this
Ligand-Target Pair