Reaction Details  Report a problem with these data
Target
Cannabinoid receptor 2
Ligand
BDBM50585659
Substrate
n/a
Meas. Tech.
ChEMBL_2163585 (CHEMBL5048446)
Ki
>100±n/a nM
Citation
 Iyer, MR; Cinar, R; Wood, CM; Zawatsky, CN; Coffey, NJ; Kim, KA; Liu, Z; Katz, A; Abdalla, J; Hassan, SA; Lee, YS Synthesis, Biological Evaluation, and Molecular Modeling Studies of 3,4-Diarylpyrazoline Series of Compounds as Potent, Nonbrain Penetrant Antagonists of Cannabinoid-1 (CB J Med Chem 65:2374-2387 (2022) [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:
BDBM50585659
Synonyms:
CHEMBL5073465
Type:
Small organic molecule
Emp. Form.:
C24H26ClF3N6O2S
Mol. Mass.:
555.015
SMILES:
C\C(N)=N\C(=N\S(=O)(=O)N1CCC(CC1)C(F)(F)F)\N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:23|
Structure:
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