Reaction Details Report a problem with these data
Target
Cannabinoid receptor 2
Ligand
BDBM50040945
Substrate
n/a
Meas. Tech.
ChEMBL_1444590 (CHEMBL3375409)
Ki
360±n/a nM
Citation
 Gianella-Borradori, M; Christou, I; Bataille, CJ; Cross, RL; Wynne, GM; Greaves, DR; Russell, AJ Ligand-based virtual screening identifies a family of selective cannabinoid receptor 2 agonists. Bioorg Med Chem 23:241-63 (2014) [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:
BDBM50040945
Synonyms:
CHEMBL3354396
Type:
Small organic molecule
Emp. Form.:
C22H17N5O3S
Mol. Mass.:
431.467
SMILES:
COC(=O)CCC(=O)n1c2ccccc2c2nnc(SCc3ccccc3C#N)nc12
Structure:
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