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BDBM50095875 CHEMBL3590632

SMILES: CCCCN1C(=O)\C(=C\NC(C)(C)C)C(=O)c2cccc(C)c12

InChI Key: InChIKey=OMGSKEDZIRSPLE-NTCAYCPXSA-N

Data: 3 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 = 50095875   
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))
BDBM50095875
PNG
(CHEMBL3590632)
Show SMILES CCCCN1C(=O)\C(=C\NC(C)(C)C)C(=O)c2cccc(C)c12
Show InChI InChI=1S/C19H26N2O2/c1-6-7-11-21-16-13(2)9-8-10-14(16)17(22)15(18(21)23)12-20-19(3,4)5/h8-10,12,20H,6-7,11H2,1-5H3/b15-12+
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PC sid
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Similars

Article
PubMed
n/an/an/an/a 20n/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Agonist activity at CB2R (unknown origin) CHO cells stably expressing Galpha16 assessed as increase in intracellular calcium level by microplate read...


J Med Chem 58: 5751-69 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00227
BindingDB Entry DOI: 10.7270/Q2Z039X8
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50095875
PNG
(CHEMBL3590632)
Show SMILES CCCCN1C(=O)\C(=C\NC(C)(C)C)C(=O)c2cccc(C)c12
Show InChI InChI=1S/C19H26N2O2/c1-6-7-11-21-16-13(2)9-8-10-14(16)17(22)15(18(21)23)12-20-19(3,4)5/h8-10,12,20H,6-7,11H2,1-5H3/b15-12+
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

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



Zhejiang University

Curated by ChEMBL


Assay Description
Agonist activity at CB1R (unknown origin) CHO cells stably expressing Galpha16 assessed as increase in intracellular calcium level by microplate read...


J Med Chem 58: 5751-69 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00227
BindingDB Entry DOI: 10.7270/Q2Z039X8
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50095875
PNG
(CHEMBL3590632)
Show SMILES CCCCN1C(=O)\C(=C\NC(C)(C)C)C(=O)c2cccc(C)c12
Show InChI InChI=1S/C19H26N2O2/c1-6-7-11-21-16-13(2)9-8-10-14(16)17(22)15(18(21)23)12-20-19(3,4)5/h8-10,12,20H,6-7,11H2,1-5H3/b15-12+
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 20n/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Agonist activity at CB2R (unknown origin) CHO cells stably expressing Galpha16 assessed as increase in intracellular calcium level by microplate read...


J Med Chem 58: 5751-69 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00227
BindingDB Entry DOI: 10.7270/Q2Z039X8
More data for this
Ligand-Target Pair