Reaction Details Report a problem with these data
Target
Cannabinoid receptor 1
Ligand
BDBM50590328
Substrate
n/a
Meas. Tech.
ChEMBL_2196296 (CHEMBL5108812)
Ki
1.2±n/a nM
Citation
 Sparkes, E; Cairns, EA; Kevin, RC; Lai, F; Grafinger, KE; Chen, S; Deventer, MH; Ellison, R; Boyd, R; Martin, LJ; McGregor, IS; Gerona, RR; Hibbs, DE; Auwärter, V; Glass, M; Stove, C; Banister, SD Structure-activity relationships of valine,  RSC Med Chem 13:156-174 (2022) [PubMed] 
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:
BDBM50590328
Synonyms:
CHEMBL5180182
Type:
Small organic molecule
Emp. Form.:
C17H24N4O2
Mol. Mass.:
316.3981
SMILES:
CCCCn1nc(C(=O)N[C@@H](C(C)C)C(N)=O)c2ccccc12 |r|
Structure:
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