Reaction Details Report a problem with these data
Target
Cannabinoid receptor 1
Ligand
BDBM50205164
Substrate
n/a
Meas. Tech.
ChEMBL_438315 (CHEMBL887423)
IC50
3.2±n/a nM
Citation
Armstrong, HE; Galka, A; Lin, LS; Lanza, TJ; Jewell, JP; Shah, SK; Guthikonda, R; Truong, Q; Chang, LL; Quaker, G; Colandrea, VJ; Tong, X; Wang, J; Xu, S; Fong, TM; Shen, CP; Lao, J; Chen, J; Shearman, LP; Stribling, DS; Rosko, K; Strack, A; Ha, S; Van der Ploeg, L; Goulet, MT; Hagmann, WK Substituted acyclic sulfonamides as human cannabinoid-1 receptor inverse agonists. Bioorg Med Chem Lett 17:2184-7 (2007) [PubMed] Article
More Info.:
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:
BDBM50205164
Synonyms:
CHEMBL230715 | N-((2S,3S)-4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide
Type:
Small organic molecule
Emp. Form.:
C25H19ClF6N2O2S
Mol. Mass.:
560.939
SMILES:
C[C@H](NS(=O)(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)[C@@H](Cc1ccc(Cl)cc1)c1cccc(c1)C#N