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BDBM50055564 CHEMBL3329480

SMILES: CCCCCc1cc(O)c2c(OC3=C(CC[C@H](C)C3)C2(C)C)c1

InChI Key: InChIKey=BXOSGIDXSREANX-AWEZNQCLSA-N

Data: 2 KI  1 EC50

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 3 hits for monomerid = 50055564   
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))
BDBM50055564
PNG
(CHEMBL3329480)
Show SMILES CCCCCc1cc(O)c2c(OC3=C(CC[C@H](C)C3)C2(C)C)c1 |r,t:12|
Show InChI InChI=1S/C21H30O2/c1-5-6-7-8-15-12-17(22)20-19(13-15)23-18-11-14(2)9-10-16(18)21(20,3)4/h12-14,22H,5-11H2,1-4H3/t14-/m0/s1
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PC cid
PC sid
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Similars

Article
PubMed
180n/an/an/an/an/an/an/an/a



University of Perugia

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human cannabinoid CB2 receptor expressed in CHO-K1 cells by liquid scintillation counting


Eur J Med Chem 85: 77-86 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.062
BindingDB Entry DOI: 10.7270/Q2NS0WKT
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50055564
PNG
(CHEMBL3329480)
Show SMILES CCCCCc1cc(O)c2c(OC3=C(CC[C@H](C)C3)C2(C)C)c1 |r,t:12|
Show InChI InChI=1S/C21H30O2/c1-5-6-7-8-15-12-17(22)20-19(13-15)23-18-11-14(2)9-10-16(18)21(20,3)4/h12-14,22H,5-11H2,1-4H3/t14-/m0/s1
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Article
PubMed
2.10E+3n/an/an/an/an/an/an/an/a



University of Perugia

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human cannabinoid CB1 receptor expressed in CHO-K1 cells by liquid scintillation counting


Eur J Med Chem 85: 77-86 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.062
BindingDB Entry DOI: 10.7270/Q2NS0WKT
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50055564
PNG
(CHEMBL3329480)
Show SMILES CCCCCc1cc(O)c2c(OC3=C(CC[C@H](C)C3)C2(C)C)c1 |r,t:12|
Show InChI InChI=1S/C21H30O2/c1-5-6-7-8-15-12-17(22)20-19(13-15)23-18-11-14(2)9-10-16(18)21(20,3)4/h12-14,22H,5-11H2,1-4H3/t14-/m0/s1
PDB

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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/an/an/a 820n/an/an/an/a



University of Perugia

Curated by ChEMBL


Assay Description
Partial agonist activity at human cannabinoid CB2 receptor expressed in CHO-K1 cells assessed as [S35]GTPgammaS binding by scintillation counting


Eur J Med Chem 85: 77-86 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.062
BindingDB Entry DOI: 10.7270/Q2NS0WKT
More data for this
Ligand-Target Pair