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BDBM50398219 CHEMBL2181541

SMILES: CCCCCCCC(C)(C)c1cc(OC)c2cc(Cc3ccccc3OC)c(=O)oc2c1

InChI Key: InChIKey=GLBHDBKJJWTLPC-UHFFFAOYSA-N

Data: 2 KI  2 IC50

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 4 hits for monomerid = 50398219   
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))
BDBM50398219
PNG
(CHEMBL2181541)
Show SMILES CCCCCCCC(C)(C)c1cc(OC)c2cc(Cc3ccccc3OC)c(=O)oc2c1
Show InChI InChI=1S/C28H36O4/c1-6-7-8-9-12-15-28(2,3)22-18-25(31-5)23-17-21(27(29)32-26(23)19-22)16-20-13-10-11-14-24(20)30-4/h10-11,13-14,17-19H,6-9,12,15-16H2,1-5H3
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Article
PubMed
1.00E+4n/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))
BDBM50398219
PNG
(CHEMBL2181541)
Show SMILES CCCCCCCC(C)(C)c1cc(OC)c2cc(Cc3ccccc3OC)c(=O)oc2c1
Show InChI InChI=1S/C28H36O4/c1-6-7-8-9-12-15-28(2,3)22-18-25(31-5)23-17-21(27(29)32-26(23)19-22)16-20-13-10-11-14-24(20)30-4/h10-11,13-14,17-19H,6-9,12,15-16H2,1-5H3
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Article
PubMed
1.00E+4n/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
N-arachidonyl glycine receptor


(Homo sapiens (Human))
BDBM50398219
PNG
(CHEMBL2181541)
Show SMILES CCCCCCCC(C)(C)c1cc(OC)c2cc(Cc3ccccc3OC)c(=O)oc2c1
Show InChI InChI=1S/C28H36O4/c1-6-7-8-9-12-15-28(2,3)22-18-25(31-5)23-17-21(27(29)32-26(23)19-22)16-20-13-10-11-14-24(20)30-4/h10-11,13-14,17-19H,6-9,12,15-16H2,1-5H3
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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
G-protein coupled receptor 55


(Homo sapiens (Human))
BDBM50398219
PNG
(CHEMBL2181541)
Show SMILES CCCCCCCC(C)(C)c1cc(OC)c2cc(Cc3ccccc3OC)c(=O)oc2c1
Show InChI InChI=1S/C28H36O4/c1-6-7-8-9-12-15-28(2,3)22-18-25(31-5)23-17-21(27(29)32-26(23)19-22)16-20-13-10-11-14-24(20)30-4/h10-11,13-14,17-19H,6-9,12,15-16H2,1-5H3
Reactome pathway
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UniProtKB/SwissProt
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GoogleScholar
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PC cid
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UniChem

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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 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