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SMILES: FC1(F)CN(C1)c1ncc(nc1OCC1CC1)C(=O)N1CC2CC1CO2

InChI Key: InChIKey=JROQHKRCBXRBCD-UHFFFAOYSA-N

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 = 260008   
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))
BDBM260008
PNG
(US9512141, 6)
Show SMILES FC1(F)CN(C1)c1ncc(nc1OCC1CC1)C(=O)N1CC2CC1CO2
Show InChI InChI=1S/C17H20F2N4O3/c18-17(19)8-22(9-17)14-15(26-6-10-1-2-10)21-13(4-20-14)16(24)23-5-12-3-11(23)7-25-12/h4,10-12H,1-3,5-9H2
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 US9512141 (2016)


BindingDB Entry DOI: 10.7270/Q2JD4VQ0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM260008
PNG
(US9512141, 6)
Show SMILES FC1(F)CN(C1)c1ncc(nc1OCC1CC1)C(=O)N1CC2CC1CO2
Show InChI InChI=1S/C17H20F2N4O3/c18-17(19)8-22(9-17)14-15(26-6-10-1-2-10)21-13(4-20-14)16(24)23-5-12-3-11(23)7-25-12/h4,10-12H,1-3,5-9H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 257n/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 US9512141 (2016)


BindingDB Entry DOI: 10.7270/Q2JD4VQ0
More data for this
Ligand-Target Pair