Reaction Details Report a problem with these data
Target
Cannabinoid receptor 2
Ligand
BDBM50356553
Substrate
n/a
Meas. Tech.
ChEMBL_776031 (CHEMBL1912501)
Ki
113.7±n/a nM
Citation
 Piscitelli, F; Ligresti, A; La Regina, G; Gatti, V; Brizzi, A; Pasquini, S; Allarà, M; Carai, MA; Novellino, E; Colombo, G; Di Marzo, V; Corelli, F; Silvestri, R 1-Aryl-5-(1H-pyrrol-1-yl)-1H-pyrazole-3-carboxamide: an effective scaffold for the design of either CB1 or CB2 receptor ligands. Eur J Med Chem 46:5641-53 (2011) [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:
BDBM50356553
Synonyms:
CHEMBL1909861
Type:
Small organic molecule
Emp. Form.:
C25H22Cl4N4O
Mol. Mass.:
536.28
SMILES:
CCc1c(nn(c1-n1c(C)ccc1C)-c1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(Cl)c(Cl)c1 |(18.79,4.76,;18.16,3.35,;19.07,2.1,;20.6,2.1,;21.08,.64,;19.83,-.27,;18.59,.64,;17.12,.19,;15.88,1.12,;15.91,2.66,;14.62,.23,;15.08,-1.24,;16.62,-1.27,;17.09,-2.64,;19.83,-1.8,;18.49,-2.57,;18.49,-4.11,;19.82,-4.88,;19.82,-6.42,;21.16,-4.11,;22.5,-4.87,;21.16,-2.57,;21.51,3.35,;20.89,4.75,;23.04,3.18,;23.95,4.43,;25.49,4.42,;26.25,3.09,;27.78,3.08,;28.56,4.41,;30.1,4.4,;27.79,5.75,;28.56,7.08,;26.25,5.75,)|
Structure:
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