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BDBM50202518 CHEMBL3946002

SMILES: CCOC(=O)c1cc(sc1NS(=O)(=O)c1ccccc1)-c1ccccc1

InChI Key: InChIKey=OSQCEKCMLJWVLL-UHFFFAOYSA-N

Data: 2 KI

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 = 50202518   
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))
BDBM50202518
PNG
(CHEMBL3946002)
Show SMILES CCOC(=O)c1cc(sc1NS(=O)(=O)c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C19H17NO4S2/c1-2-24-19(21)16-13-17(14-9-5-3-6-10-14)25-18(16)20-26(22,23)15-11-7-4-8-12-15/h3-13,20H,2H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 receptor expressed in HEK293 cell membranes after 90 mins by radioligand binding assay


Eur J Med Chem 122: 619-634 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.012
BindingDB Entry DOI: 10.7270/Q2057HX9
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50202518
PNG
(CHEMBL3946002)
Show SMILES CCOC(=O)c1cc(sc1NS(=O)(=O)c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C19H17NO4S2/c1-2-24-19(21)16-13-17(14-9-5-3-6-10-14)25-18(16)20-26(22,23)15-11-7-4-8-12-15/h3-13,20H,2H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 receptor expressed in HEK293 cell membranes after 90 mins by radioligand binding assay


Eur J Med Chem 122: 619-634 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.012
BindingDB Entry DOI: 10.7270/Q2057HX9
More data for this
Ligand-Target Pair