Reaction Details Report a problem with these data
Target
Cannabinoid receptor 1
Ligand
BDBM50463396
Substrate
n/a
Meas. Tech.
ChEMBL_1778204 (CHEMBL4235196)
Ki
5.0±n/a nM
Citation
 Amato, GS; Manke, A; Vasukuttan, V; Wiethe, RW; Snyder, RW; Runyon, SP; Maitra, R Synthesis and pharmacological characterization of functionalized 6-piperazin-1-yl-purines as cannabinoid receptor 1 (CB1) inverse agonists. Bioorg Med Chem 26:4518-4531 (2018) [PubMed]  Article 
Target
Name:
Cannabinoid receptor 1
Synonyms:
CANN6 | CANNABINOID CB1 | CB-R | CB1 | CNR | CNR1 | CNR1_HUMAN | Cannabinoid CB1 receptor | Cannabinoid receptor | Cannabinoid receptor 1 (CB1) | Cannabinoid receptor 1 (brain)
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
52868.96
Organism:
Homo sapiens (Human)
Description:
P21554
Residue:
472
Sequence:
MKSILDGLADTTFRTITTDLLYVGSNDIQYEDIKGDMASKLGYFPQKFPLTSFRGSPFQEKMTAGDNPQLVPADQVNITEFYNKSLSSFKENEENIQCGENFMDIECFMVLNPSQQLAIAVLSLTLGTFTVLENLLVLCVILHSRSLRCRPSYHFIGSLAVADLLGSVIFVYSFIDFHVFHRKDSRNVFLFKLGGVTASFTASVGSLFLTAIDRYISIHRPLAYKRIVTRPKAVVAFCLMWTIAIVIAVLPLLGWNCEKLQSVCSDIFPHIDETYLMFWIGVTSVLLLFIVYAYMYILWKAHSHAVRMIQRGTQKSIIIHTSEDGKVQVTRPDQARMDIRLAKTLVLILVVLIICWGPLLAIMVYDVFGKMNKLIKTVFAFCSMLCLLNSTVNPIIYALRSKDLRHAFRSMFPSCEGTAQPLDNSMGDSDCLHKHANNAASVHRAAESCIKSTVKIAKVTMSVSTDTSAEAL
  
Inhibitor
Name:
BDBM50463396
Synonyms:
CHEMBL4237291
Type:
Small organic molecule
Emp. Form.:
C30H24Cl2N6O3
Mol. Mass.:
587.456
SMILES:
Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(=O)C1COc2ccccc2O1)-c1ccccc1Cl
Structure:
Search PDB for entries with ligand similarity: