Reaction Details  Report a problem with these data
Target
Cannabinoid receptor 1
Ligand
BDBM50060617
Substrate
n/a
Meas. Tech.
ChEMBL_46468 (CHEMBL858761)
Ki
5.8±n/a nM
Citation
 Fichera, M; Cruciani, G; Bianchi, A; Musumarra, G A 3D-QSAR study on the structural requirements for binding to CB(1) and CB(2) cannabinoid receptors. J Med Chem 43:2300-9 (2000) [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:
BDBM50060617
Synonyms:
(5Z,8Z,11Z,14Z)-2-Methyl-icosa-5,8,11,14-tetraenoic acid (2-fluoro-ethyl)-amide | 2-Methyl-icosa-5,8,11,14-tetraenoic acid (2-fluoro-ethyl)-amide (0689) | CHEMBL309042
Type:
Small organic molecule
Emp. Form.:
C23H38FNO
Mol. Mass.:
363.5523
SMILES:
CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCC(C)C(=O)NCCF
Structure:
Search PDB for entries with ligand similarity: