Reaction Details Report a problem with these data
Target
Cannabinoid receptor 2
Ligand
BDBM50163123
Substrate
n/a
Meas. Tech.
ChEMBL_303194 (CHEMBL829820)
Ki
208±n/a nM
Citation
 Lange, JH; van Stuivenberg, HH; Coolen, HK; Adolfs, TJ; McCreary, AC; Keizer, HG; Wals, HC; Veerman, W; Borst, AJ; de Looff, W; Verveer, PC; Kruse, CG Bioisosteric replacements of the pyrazole moiety of rimonabant: synthesis, biological properties, and molecular modeling investigations of thiazoles, triazoles, and imidazoles as potent and selective CB1 cannabinoid receptor antagonists. J Med Chem 48:1823-38 (2005) [PubMed]  Article 
Target
Name:
Cannabinoid receptor 2
Synonyms:
CANNABINOID CB2 | CB-2 | CB2 | CB2A | CB2B | CNR2 | CNR2_HUMAN | CX5 | Cannabinoid CB2 receptor | Cannabinoid receptor 2 (CB2) | Cannabinoid receptor 2 (CB2R) | hCB2
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
39690.94
Organism:
Homo sapiens (Human)
Description:
P34972
Residue:
360
Sequence:
MEECWVTEIANGSKDGLDSNPMKDYMILSGPQKTAVAVLCTLLGLLSALENVAVLYLILSSHQLRRKPSYLFIGSLAGADFLASVVFACSFVNFHVFHGVDSKAVFLLKIGSVTMTFTASVGSLLLTAIDRYLCLRYPPSYKALLTRGRALVTLGIMWVLSALVSYLPLMGWTCCPRPCSELFPLIPNDYLLSWLLFIAFLFSGIIYTYGHVLWKAHQHVASLSGHQDRQVPGMARMRLDVRLAKTLGLVLAVLLICWFPVLALMAHSLATTLSDQVKKAFAFCSMLCLINSMVNPVIYALRSGEIRSSAHHCLAHWKKCVRGLGSEAKEEAPRSSVTETEADGKITPWPDSRDLDLSDC
  
Inhibitor
Name:
BDBM50163123
Synonyms:
2-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-5-methyl-1H-imidazole-4-carboxylic acid piperidin-1-ylamide | CHEMBL439657
Type:
Small organic molecule
Emp. Form.:
C22H21Cl3N4O
Mol. Mass.:
463.787
SMILES:
Cc1c(nc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1 |(2.6,-.33,;1.08,-.01,;.47,1.42,;-1.07,1.24,;-1.39,-.26,;-2.75,-.4,;-3.52,-1.76,;-5.06,-1.75,;-5.83,-.4,;-7.37,-.4,;-5.06,.91,;-3.52,.91,;-.06,-1.03,;-.06,-2.57,;1.24,-3.34,;1.24,-4.88,;-.09,-5.63,;-.11,-7.17,;-1.42,-4.86,;-1.39,-3.32,;-2.73,-2.53,;1.24,2.73,;1.17,4.27,;2.71,2.35,;3.8,3.45,;5.3,3.03,;6.38,4.12,;5.98,5.59,;4.49,6.01,;3.39,4.9,)|
Structure:
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