Reaction Details Report a problem with these data
Target
Cannabinoid receptor 1
Ligand
BDBM50323760
Substrate
n/a
Meas. Tech.
ChEMBL_646966 (CHEMBL1217107)
Ki
15000±n/a nM
Citation
 Dixon, DD; Sethumadhavan, D; Benneche, T; Banaag, AR; Tius, MA; Thakur, GA; Bowman, A; Wood, JT; Makriyannis, A Heteroadamantyl cannabinoids. J Med Chem 53:5656-66 (2010) [PubMed]  Article 
Target
Name:
Cannabinoid receptor 1
Synonyms:
Brain-type cannabinoid receptor | CANNABINOID CB1 | CB-R | CB1 | CNR1_RAT | Cannabinoid CB1 receptor | Cannabinoid receptor | Cannabinoid receptor 1 (CB1) | Cnr1 | Skr6
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
52856.55
Organism:
Rattus norvegicus (rat)
Description:
P20272
Residue:
473
Sequence:
MKSILDGLADTTFRTITTDLLYVGSNDIQYEDIKGDMASKLGYFPQKFPLTSFRGSPFQEKMTAGDNSPLVPAGDTTNITEFYNKSLSSFKENEENIQCGENFMDMECFMILNPSQQLAIAVLSLTLGTFTVLENLLVLCVILHSRSLRCRPSYHFIGSLAVADLLGSVIFVYSFVDFHVFHRKDSPNVFLFKLGGVTASFTASVGSLFLTAIDRYISIHRPLAYKRIVTRPKAVVAFCLMWTIAIVIAVLPLLGWNCKKLQSVCSDIFPLIDETYLMFWIGVTSVLLLFIVYAYMYILWKAHSHAVRMIQRGTQKSIIIHTSEDGKVQVTRPDQARMDIRLAKTLVLILVVLIICWGPLLAIMVYDVFGKMNKLIKTVFAFCSMLCLLNSTVNPIIYALRSKDLRHAFRSMFPSCEGTAQPLDNSMGDSDCLHKHANNTASMHRAAESCIKSTVKIAKVTMSVSTDTSAEAL
  
Inhibitor
Name:
BDBM50323760
Synonyms:
(6aR,9R,10aR)-1,9-Dihydroxy-6,6-dimethyl-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromene-3-carboxylic acid adamantan-2-ylamide | CHEMBL1214500
Type:
Small organic molecule
Emp. Form.:
C26H35NO4
Mol. Mass.:
425.5604
SMILES:
CC1(C)Oc2cc(cc(O)c2[C@@H]2C[C@H](O)CC[C@@H]12)C(=O)NC1C2CC3CC(C2)CC1C3 |r,wU:11.11,13.14,wD:17.17,TLB:30:29:27:24.23.25,THB:20:21:27:24.23.25,30:24:27:21.29.28,25:26:21:24.23.30,25:24:21:26.27.28,(20.12,-22.66,;20.14,-21.12,;18.79,-21.89,;21.47,-21.9,;22.81,-21.12,;24.14,-21.9,;25.49,-21.13,;25.49,-19.58,;24.15,-18.81,;24.15,-17.27,;22.82,-19.58,;21.47,-18.81,;21.47,-17.27,;20.14,-16.5,;20.13,-14.96,;18.81,-17.27,;18.81,-18.81,;20.14,-19.58,;26.82,-21.9,;28.16,-21.13,;26.82,-23.44,;25.48,-24.21,;24.1,-24.72,;24.13,-26.31,;23.11,-27.55,;21.7,-26.99,;21.69,-25.46,;22.69,-24.17,;23.08,-25.1,;24.41,-25.57,;24.45,-27.06,)|
Structure:
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