Reaction Details Report a problem with these data
Target
Cannabinoid receptor 1
Ligand
BDBM50230398
Substrate
n/a
Meas. Tech.
ChEMBL_1644839 (CHEMBL3993768)
Ki
7.9±n/a nM
Citation
 Iyer, MR; Cinar, R; Katz, A; Gao, M; Erdelyi, K; Jourdan, T; Coffey, NJ; Pacher, P; Kunos, G Design, Synthesis, and Biological Evaluation of Novel, Non-Brain-Penetrant, Hybrid Cannabinoid CB J Med Chem 60:1126-1141 (2017) [PubMed]  Article 
Target
Name:
Cannabinoid receptor 1
Synonyms:
Brain-type cannabinoid receptor | CANNABINOID CB1 | CB-R | CB1 | CNR1_MOUSE | Cannabinoid CB1 receptor | Cannabinoid receptor | Cnr1
Type:
Enzyme
Mol. Mass.:
52842.52
Organism:
Mus musculus (Mouse)
Description:
P47746
Residue:
473
Sequence:
MKSILDGLADTTFRTITTDLLYVGSNDIQYEDIKGDMASKLGYFPQKFPLTSFRGSPFQEKMTAGDNSPLVPAGDTTNITEFYNKSLSSFKENEDNIQCGENFMDMECFMILNPSQQLAIAVLSLTLGTFTVLENLLVLCVILHSRSLRCRPSYHFIGSLAVADLLGSVIFVYSFVDFHVFHRKDSPNVFLFKLGGVTASFTASVGSLFLTAIDRYISIHRPLAYKRIVTRPKAVVAFCLMWTIAIVIAVLPLLGWNCKKLQSVCSDIFPLIDETYLMFWIGVTSVLLLFIVYAYMYILWKAHSHAVRMIQRGTQKSIIIHTSEDGKVQVTRPDQARMDIRLAKTLVLILVVLIICWGPLLAIMVYDVFGKMNKLIKTVFAFCSMLCLLNSTVNPIIYALRSKDLRHAFRSMFPSCEGTAQPLDNSMGDSDCLHKHANNTASMHRAAESCIKSTVKIAKVTMSVSTDTSAEAL
  
Inhibitor
Name:
BDBM50230398
Synonyms:
CHEMBL4093905
Type:
Small organic molecule
Emp. Form.:
C24H21Cl2N5O2S
Mol. Mass.:
514.427
SMILES:
C\C(N)=N/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/N1C[C@@H](C(=N1)c1ccc(Cl)cc1)c1ccccc1 |r,c:20|
Structure:
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