Reaction Details Report a problem with these data
Target
Cannabinoid receptor 1
Ligand
BDBM50029967
Substrate
n/a
Meas. Tech.
ChEMBL_1438383 (CHEMBL3383058)
Ki
908±n/a nM
Citation
 Lucchesi, V; Hurst, DP; Shore, DM; Bertini, S; Ehrmann, BM; Allarà, M; Lawrence, L; Ligresti, A; Minutolo, F; Saccomanni, G; Sharir, H; Macchia, M; Di Marzo, V; Abood, ME; Reggio, PH; Manera, C CB2-selective cannabinoid receptor ligands: synthesis, pharmacological evaluation, and molecular modeling investigation of 1,8-Naphthyridin-2(1H)-one-3-carboxamides. J Med Chem 57:8777-91 (2014) [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:
BDBM50029967
Synonyms:
CHEMBL3353424
Type:
Small organic molecule
Emp. Form.:
C21H29N3O2
Mol. Mass.:
355.4739
SMILES:
CCCCCn1c2ncccc2cc(C(=O)NC2CCC(C)CC2)c1=O |(20.05,-6.85,;18.71,-7.62,;17.38,-6.86,;16.05,-7.63,;14.71,-6.86,;14.71,-5.32,;13.37,-4.55,;12.04,-5.33,;10.7,-4.56,;10.71,-3.02,;12.04,-2.25,;13.37,-3.01,;14.7,-2.24,;16.03,-3,;17.36,-2.22,;17.35,-.68,;18.7,-2.98,;20.03,-2.2,;21.37,-2.97,;22.7,-2.2,;22.69,-.66,;24.03,.12,;21.36,.11,;20.02,-.67,;16.04,-4.55,;17.38,-5.31,)|
Structure:
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