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SMILES: CNC(=O)CC1(COC1)NC(=O)c1ccc(C2CC2)c(OCC2CC2)n1

InChI Key: InChIKey=GUBZREBIEPAYBB-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 260090   
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 1


(Homo sapiens (Human))
BDBM260090
PNG
(US9522886, 38)
Show SMILES CNC(=O)CC1(COC1)NC(=O)c1ccc(C2CC2)c(OCC2CC2)n1
Show InChI InChI=1S/C19H25N3O4/c1-20-16(23)8-19(10-25-11-19)22-17(24)15-7-6-14(13-4-5-13)18(21-15)26-9-12-2-3-12/h6-7,12-13H,2-5,8-11H2,1H3,(H,20,23)(H,22,24)
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>1.00E+4n/an/an/a37



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
CHO cells expressing human CB1 or CB2 receptors are seeded 17-24 hours prior to the experiment 50.000 cells per well in a black 96 well plate with fl...


US Patent US9522886 (2016)


BindingDB Entry DOI: 10.7270/Q28W3C7W
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM260090
PNG
(US9522886, 38)
Show SMILES CNC(=O)CC1(COC1)NC(=O)c1ccc(C2CC2)c(OCC2CC2)n1
Show InChI InChI=1S/C19H25N3O4/c1-20-16(23)8-19(10-25-11-19)22-17(24)15-7-6-14(13-4-5-13)18(21-15)26-9-12-2-3-12/h6-7,12-13H,2-5,8-11H2,1H3,(H,20,23)(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 101n/an/an/a37



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
CHO cells expressing human CB1 or CB2 receptors are seeded 17-24 hours prior to the experiment 50.000 cells per well in a black 96 well plate with fl...


US Patent US9522886 (2016)


BindingDB Entry DOI: 10.7270/Q28W3C7W
More data for this
Ligand-Target Pair