Reaction Details Report a problem with these data
Target
Cannabinoid receptor 2
Ligand
BDBM50224050
Substrate
n/a
Meas. Tech.
ChEMBL_450409 (CHEMBL900693)
Ki
119±n/a nM
Citation
 Stern, E; Muccioli, GG; Bosier, B; Hamtiaux, L; Millet, R; Poupaert, JH; Hénichart, JP; Depreux, P; Goossens, JF; Lambert, DM Pharmacomodulations around the 4-oxo-1,4-dihydroquinoline-3-carboxamides, a class of potent CB2-selective cannabinoid receptor ligands: consequences in receptor affinity and functionality. J Med Chem 50:5471-84 (2007) [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:
BDBM50224050
Synonyms:
CHEMBL393931 | N3-(1-(3,5-dimethyl)adamantyl)-4-oxo-2-phenyl-1-pentyl-1,4-dihydroquinoline-3-carboxamide
Type:
Small organic molecule
Emp. Form.:
C33H40N2O2
Mol. Mass.:
496.6829
SMILES:
CCCCCn1c(-c2ccccc2)c(C(=O)NC23CC4CC(C)(CC(C)(C4)C2)C3)c(=O)c2ccccc12 |w:19.20,17.17,21.22,24.25,TLB:28:17:26:23.21.20,THB:27:24:20:18.17.28,27:17:26.24.23:20,28:21:26:18.27.17,TEB:16:17:26:23.21.20,16:17:26.24.23:20,22:21:26:18.27.17,22:21:18:26.24.27,25:24:20:18.17.28,25:24:18:21.20.28|
Structure:
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