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BDBM50301313 2-methyl-N-(4-methyl-3-(morpholinomethyl)phenyl)cyclohexanecarboxamide::CHEMBL577686

SMILES: CC1CCCCC1C(=O)Nc1ccc(C)c(CN2CCOCC2)c1

InChI Key: InChIKey=DJDCZALMEJMMLS-UHFFFAOYSA-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 = 50301313   
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))
BDBM50301313
PNG
(2-methyl-N-(4-methyl-3-(morpholinomethyl)phenyl)cy...)
Show SMILES CC1CCCCC1C(=O)Nc1ccc(C)c(CN2CCOCC2)c1
Show InChI InChI=1S/C20H30N2O2/c1-15-7-8-18(13-17(15)14-22-9-11-24-12-10-22)21-20(23)19-6-4-3-5-16(19)2/h7-8,13,16,19H,3-6,9-12,14H2,1-2H3,(H,21,23)
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Article
PubMed
70n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 receptor expressed in CHO cells


Bioorg Med Chem Lett 19: 5004-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.057
BindingDB Entry DOI: 10.7270/Q25M65S1
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50301313
PNG
(2-methyl-N-(4-methyl-3-(morpholinomethyl)phenyl)cy...)
Show SMILES CC1CCCCC1C(=O)Nc1ccc(C)c(CN2CCOCC2)c1
Show InChI InChI=1S/C20H30N2O2/c1-15-7-8-18(13-17(15)14-22-9-11-24-12-10-22)21-20(23)19-6-4-3-5-16(19)2/h7-8,13,16,19H,3-6,9-12,14H2,1-2H3,(H,21,23)
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PubMed
1.60E+3n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 19: 5004-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.057
BindingDB Entry DOI: 10.7270/Q25M65S1
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50301313
PNG
(2-methyl-N-(4-methyl-3-(morpholinomethyl)phenyl)cy...)
Show SMILES CC1CCCCC1C(=O)Nc1ccc(C)c(CN2CCOCC2)c1
Show InChI InChI=1S/C20H30N2O2/c1-15-7-8-18(13-17(15)14-22-9-11-24-12-10-22)21-20(23)19-6-4-3-5-16(19)2/h7-8,13,16,19H,3-6,9-12,14H2,1-2H3,(H,21,23)
PDB

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PC cid
PC sid
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Article
PubMed
n/an/an/an/a 76n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 19: 5004-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.057
BindingDB Entry DOI: 10.7270/Q25M65S1
More data for this
Ligand-Target Pair