Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetCannabinoid receptor 2
LigandBDBM50029964
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1438384 (CHEMBL3383059)
Ki 0.680000±n/a nM
Citation Lucchesi, VHurst, DPShore, DMBertini, SEhrmann, BMAllarà, MLawrence, LLigresti, AMinutolo, FSaccomanni, GSharir, HMacchia, MDi Marzo, VAbood, MEReggio, PHManera, C CB2-selective cannabinoid receptor ligands: synthesis, pharmacological evaluation, and molecular modeling investigation of 1,8-Naphthyridin-2(1H)-one-3-carboxamides. J Med Chem57:8777-91 (2014) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Cannabinoid receptor 2
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:
MEECWVTEIANGSKDGLDSNPMKDYMILSGPQKTAVAVLCTLLGLLSALENVAVLYLILS
SHQLRRKPSYLFIGSLAGADFLASVVFACSFVNFHVFHGVDSKAVFLLKIGSVTMTFTAS
VGSLLLTAIDRYLCLRYPPSYKALLTRGRALVTLGIMWVLSALVSYLPLMGWTCCPRPCS
ELFPLIPNDYLLSWLLFIAFLFSGIIYTYGHVLWKAHQHVASLSGHQDRQVPGMARMRLD
VRLAKTLGLVLAVLLICWFPVLALMAHSLATTLSDQVKKAFAFCSMLCLINSMVNPVIYA
LRSGEIRSSAHHCLAHWKKCVRGLGSEAKEEAPRSSVTETEADGKITPWPDSRDLDLSDC
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50029964
n/a
NameBDBM50029964
Synonyms:CHEMBL3353453
TypeSmall organic molecule
Emp. Form.C28H33FN4O3
Mol. Mass.492.585
SMILESCC1CCC(CC1)NC(=O)c1cc2cc(cnc2n(CCN2CCOCC2)c1=O)-c1ccc(F)cc1 |(17.97,-16.85,;16.63,-17.62,;16.64,-19.16,;15.31,-19.93,;13.97,-19.16,;13.96,-17.63,;15.3,-16.86,;12.64,-19.94,;11.31,-19.18,;11.3,-17.64,;9.98,-19.96,;8.64,-19.2,;7.32,-19.97,;5.98,-19.21,;4.65,-19.98,;4.65,-21.52,;5.98,-22.29,;7.32,-21.51,;8.65,-22.28,;8.66,-23.82,;9.99,-24.58,;9.99,-26.12,;8.67,-26.89,;8.67,-28.43,;10,-29.2,;11.33,-28.43,;11.33,-26.89,;9.99,-21.51,;11.32,-22.27,;3.32,-19.21,;3.31,-17.66,;1.97,-16.9,;.64,-17.67,;-.7,-16.9,;.64,-19.22,;1.98,-19.98,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: