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BDBM50154566 CHEMBL3775054

SMILES: CCCCCn1cc(C(=O)NC2CCCCCC2)c(=O)n2nc(nc12)N1CCOCC1

InChI Key: InChIKey=PZXDSEKORSHOEB-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50154566   
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))
BDBM50154566
PNG
(CHEMBL3775054)
Show SMILES CCCCCn1cc(C(=O)NC2CCCCCC2)c(=O)n2nc(nc12)N1CCOCC1
Show InChI InChI=1S/C22H34N6O3/c1-2-3-8-11-27-16-18(19(29)23-17-9-6-4-5-7-10-17)20(30)28-22(27)24-21(25-28)26-12-14-31-15-13-26/h16-17H,2-15H2,1H3,(H,23,29)
PDB

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PC cid
PC sid
UniChem

Similars

PubMed
566n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB2 receptor expressed in CHO cell membranes after 60 mins by scintillation counting analysis


Eur J Med Chem 113: 11-27 (2016)


BindingDB Entry DOI: 10.7270/Q21J9CPC
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50154566
PNG
(CHEMBL3775054)
Show SMILES CCCCCn1cc(C(=O)NC2CCCCCC2)c(=O)n2nc(nc12)N1CCOCC1
Show InChI InChI=1S/C22H34N6O3/c1-2-3-8-11-27-16-18(19(29)23-17-9-6-4-5-7-10-17)20(30)28-22(27)24-21(25-28)26-12-14-31-15-13-26/h16-17H,2-15H2,1H3,(H,23,29)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB1 receptor expressed in CHO cell membranes after 90 mins by scintillation counting analysis


Eur J Med Chem 113: 11-27 (2016)


BindingDB Entry DOI: 10.7270/Q21J9CPC
More data for this
Ligand-Target Pair