BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 350.4
BDBM50398233

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 5 hits in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50398233
PNG
(CHEMBL2177253)
Show SMILES CCCCCc1cc(OC)c2cc(Cc3ccccc3C)c(=O)oc2c1
Show InChI InChI=1S/C23H26O3/c1-4-5-6-10-17-12-21(25-3)20-15-19(23(24)26-22(20)13-17)14-18-11-8-7-9-16(18)2/h7-9,11-13,15H,4-6,10,14H2,1-3H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
22n/an/an/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human CB1 receptor expressed in CHO cells after 2 hrs by liquid scintillation counter


J Med Chem 55: 7967-77 (2012)


Article DOI: 10.1021/jm3008213
BindingDB Entry DOI: 10.7270/Q2JM2BRJ
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50398233
PNG
(CHEMBL2177253)
Show SMILES CCCCCc1cc(OC)c2cc(Cc3ccccc3C)c(=O)oc2c1
Show InChI InChI=1S/C23H26O3/c1-4-5-6-10-17-12-21(25-3)20-15-19(23(24)26-22(20)13-17)14-18-11-8-7-9-16(18)2/h7-9,11-13,15H,4-6,10,14H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
405n/an/an/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human CB2 receptor expressed in CHO cells after 2 hrs by liquid scintillation counter


J Med Chem 55: 7967-77 (2012)


Article DOI: 10.1021/jm3008213
BindingDB Entry DOI: 10.7270/Q2JM2BRJ
More data for this
Ligand-Target Pair
G-protein coupled receptor 55


(Homo sapiens (Human))
BDBM50398233
PNG
(CHEMBL2177253)
Show SMILES CCCCCc1cc(OC)c2cc(Cc3ccccc3C)c(=O)oc2c1
Show InChI InChI=1S/C23H26O3/c1-4-5-6-10-17-12-21(25-3)20-15-19(23(24)26-22(20)13-17)14-18-11-8-7-9-16(18)2/h7-9,11-13,15H,4-6,10,14H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.08E+3n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Antagonist activity at human GPR55 transfected in CHO cells assessed as inhibition of LPI-induced beta-arrestin recruitment incubated 60 mins prior t...


J Med Chem 56: 4798-810 (2013)


Article DOI: 10.1021/jm4005175
BindingDB Entry DOI: 10.7270/Q2GM88QX
More data for this
Ligand-Target Pair
N-arachidonyl glycine receptor


(Homo sapiens (Human))
BDBM50398233
PNG
(CHEMBL2177253)
Show SMILES CCCCCc1cc(OC)c2cc(Cc3ccccc3C)c(=O)oc2c1
Show InChI InChI=1S/C23H26O3/c1-4-5-6-10-17-12-21(25-3)20-15-19(23(24)26-22(20)13-17)14-18-11-8-7-9-16(18)2/h7-9,11-13,15H,4-6,10,14H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



University of Bonn

Curated by ChEMBL


Assay Description
Antagonist activity at human GPR18 transfected in CHO cells assessed as delta9-THC-induced beta-arrestin recruitment incubated 60 mins prior to delta...


J Med Chem 56: 4798-810 (2013)


Article DOI: 10.1021/jm4005175
BindingDB Entry DOI: 10.7270/Q2GM88QX
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50398233
PNG
(CHEMBL2177253)
Show SMILES CCCCCc1cc(OC)c2cc(Cc3ccccc3C)c(=O)oc2c1
Show InChI InChI=1S/C23H26O3/c1-4-5-6-10-17-12-21(25-3)20-15-19(23(24)26-22(20)13-17)14-18-11-8-7-9-16(18)2/h7-9,11-13,15H,4-6,10,14H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 213n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-stimulated cAMP accumulation using [3H]-cAMP after ...


J Med Chem 55: 7967-77 (2012)


Article DOI: 10.1021/jm3008213
BindingDB Entry DOI: 10.7270/Q2JM2BRJ
More data for this
Ligand-Target Pair