BindingDB logo
myBDB logout

BDBM50072351 CHEMBL3409319

SMILES: CCOCCn1cc(C(=O)NCCc2ccccc2)c(=O)c2cccc(OC)c12

InChI Key: InChIKey=QKCBUMJCRHUCAH-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 = 50072351   
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))
BDBM50072351
PNG
(CHEMBL3409319)
Show SMILES CCOCCn1cc(C(=O)NCCc2ccccc2)c(=O)c2cccc(OC)c12
Show InChI InChI=1S/C23H26N2O4/c1-3-29-15-14-25-16-19(22(26)18-10-7-11-20(28-2)21(18)25)23(27)24-13-12-17-8-5-4-6-9-17/h4-11,16H,3,12-15H2,1-2H3,(H,24,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
360n/an/an/an/an/an/an/an/a



Institute of Pharmaceutical Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 receptor transfected in CHOK1 cells after 90 mins by liquid scintillation counting analysis


Eur J Med Chem 92: 554-64 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.028
BindingDB Entry DOI: 10.7270/Q2BP04H0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50072351
PNG
(CHEMBL3409319)
Show SMILES CCOCCn1cc(C(=O)NCCc2ccccc2)c(=O)c2cccc(OC)c12
Show InChI InChI=1S/C23H26N2O4/c1-3-29-15-14-25-16-19(22(26)18-10-7-11-20(28-2)21(18)25)23(27)24-13-12-17-8-5-4-6-9-17/h4-11,16H,3,12-15H2,1-2H3,(H,24,27)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Institute of Pharmaceutical Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 receptor transfected in CHOK1 cells after 90 mins by liquid scintillation counting analysis


Eur J Med Chem 92: 554-64 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.028
BindingDB Entry DOI: 10.7270/Q2BP04H0
More data for this
Ligand-Target Pair