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BDBM50172174 CHEMBL197777::N-{4-[4-Methoxy-2-(4-methoxy-benzenesulfonyl)-benzenesulfonyl]-benzyl}-methanesulfonamide

SMILES: COc1ccc(cc1)S(=O)(=O)c1cc(OC)ccc1S(=O)(=O)c1ccc(CNS(C)(=O)=O)cc1

InChI Key: InChIKey=XLYRXCZZVVWYNM-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50172174   
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
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50172174
PNG
(CHEMBL197777 | N-{4-[4-Methoxy-2-(4-methoxy-benzen...)
Show SMILES COc1ccc(cc1)S(=O)(=O)c1cc(OC)ccc1S(=O)(=O)c1ccc(CNS(C)(=O)=O)cc1
Show InChI InChI=1S/C22H23NO8S3/c1-30-17-6-11-20(12-7-17)34(28,29)22-14-18(31-2)8-13-21(22)33(26,27)19-9-4-16(5-10-19)15-23-32(3,24)25/h4-14,23H,15H2,1-3H3
PDB

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PC cid
PC sid
UniChem
Article
PubMed
1.30n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibition constant against Cannabinoid receptor 2


Bioorg Med Chem Lett 15: 4417-20 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.023
BindingDB Entry DOI: 10.7270/Q24T6HXQ
More data for this
Ligand-Target Pair